Browse entries in the PDBbind-CN Database
HEADER 5O3Q_COMPLEX COMPND 5O3Q_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 40 ALA LYS PRO ALA ASN LYS LEU VAL ILE VAL THR GLU LYS SEQRES 2 A 40 ILE LEU LEU LYS LYS ILE ALA LYS ILE ILE ASP GLU SER SEQRES 3 A 40 GLY ALA LYS GLY TYR THR VAL MET ASN THR GLY GLY LYS SEQRES 4 A 40 GLY SEQRES 1 A 58 SER ASP ILE GLU ALA ASN ILE LYS PHE GLU ILE LEU THR SEQRES 2 A 58 GLU THR ARG GLU MET ALA GLU GLU ILE ALA ASP ARG VAL SEQRES 3 A 58 ALA VAL LYS TYR PHE ASN ASP TYR ALA GLY ILE ILE TYR SEQRES 4 A 58 ILE CYS SER ALA GLU VAL LEU TYR GLY HIS THR PHE CYS SEQRES 5 A 58 GLY PRO GLU GLY CYS SER SEQRES 1 B 40 ALA LYS PRO ALA ASN LYS LEU VAL ILE VAL THR GLU LYS SEQRES 2 B 40 ILE LEU LEU LYS LYS ILE ALA LYS ILE ILE ASP GLU SER SEQRES 3 B 40 GLY ALA LYS GLY TYR THR VAL MET ASN THR GLY GLY LYS SEQRES 4 B 40 GLY SEQRES 1 B 61 SER ASP ILE GLU ALA ASN ILE LYS PHE GLU ILE LEU THR SEQRES 2 B 61 GLU THR ARG GLU MET ALA GLU GLU ILE ALA ASP ARG VAL SEQRES 3 B 61 ALA VAL LYS TYR PHE ASN ASP TYR ALA GLY ILE ILE TYR SEQRES 4 B 61 ILE CYS SER ALA GLU VAL LEU TYR GLY HIS THR PHE CYS SEQRES 5 B 61 GLY PRO GLU GLY CYS SER ALA TRP SER SEQRES 1 C 40 ALA LYS PRO ALA ASN LYS LEU VAL ILE VAL THR GLU LYS SEQRES 2 C 40 ILE LEU LEU LYS LYS ILE ALA LYS ILE ILE ASP GLU SER SEQRES 3 C 40 GLY ALA LYS GLY TYR THR VAL MET ASN THR GLY GLY LYS SEQRES 4 C 40 GLY SEQRES 1 C 59 ILE GLU ALA ASN ILE LYS PHE GLU ILE LEU THR GLU THR SEQRES 2 C 59 ARG GLU MET ALA GLU GLU ILE ALA ASP ARG VAL ALA VAL SEQRES 3 C 59 LYS TYR PHE ASN ASP TYR ALA GLY ILE ILE TYR ILE CYS SEQRES 4 C 59 SER ALA GLU VAL LEU TYR GLY HIS THR PHE CYS GLY PRO SEQRES 5 C 59 GLU GLY CYS SER ALA TRP SER HET CMP A 466 33 SSBOND 1 CYS A 105 CYS A 110 SSBOND 2 CYS B 105 CYS B 110 SSBOND 3 CYS C 105 CYS C 110 ATOM 1 N ALA A 2 4.763 34.409 -0.302 1.00 43.07 N ATOM 2 CA ALA A 2 3.637 33.435 -0.213 1.00 41.31 C ATOM 3 C ALA A 2 2.405 34.180 0.229 1.00 42.43 C ATOM 4 O ALA A 2 2.506 35.190 0.905 1.00 42.58 O ATOM 5 CB ALA A 2 4.001 32.371 0.791 1.00 41.76 C ATOM 6 HN3 ALA A 2 4.921 34.841 0.631 1.00 0.00 H ATOM 7 HN2 ALA A 2 4.525 35.150 -0.992 1.00 0.00 H ATOM 8 HN1 ALA A 2 5.625 33.913 -0.606 1.00 0.00 H ATOM 9 N LYS A 3 1.246 33.713 -0.194 1.00 34.53 N ATOM 10 CA LYS A 3 0.009 34.357 0.117 1.00 36.85 C ATOM 11 C LYS A 3 -0.812 33.441 0.988 1.00 35.25 C ATOM 12 O LYS A 3 -1.109 32.316 0.585 1.00 34.67 O ATOM 13 CB LYS A 3 -0.741 34.728 -1.156 1.00 39.56 C ATOM 14 CG LYS A 3 -1.915 35.646 -0.904 1.00 43.15 C ATOM 15 CD LYS A 3 -2.425 36.203 -2.221 1.00 44.50 C ATOM 16 CE LYS A 3 -3.470 37.266 -1.972 1.00 46.26 C ATOM 17 NZ LYS A 3 -4.684 36.975 -2.774 1.00 45.83 N ATOM 18 HZ1 LYS A 3 -4.437 36.965 -3.784 1.00 0.00 H ATOM 19 HZ2 LYS A 3 -5.065 36.047 -2.500 1.00 0.00 H ATOM 20 HZ3 LYS A 3 -5.399 37.710 -2.598 1.00 0.00 H ATOM 21 H LYS A 3 1.232 32.849 -0.772 1.00 0.00 H ATOM 22 N PRO A 4 -1.193 33.923 2.204 1.00 35.69 N ATOM 23 CA PRO A 4 -2.031 33.078 3.062 1.00 34.41 C ATOM 24 C PRO A 4 -3.348 32.705 2.384 1.00 34.51 C ATOM 25 O PRO A 4 -3.954 33.531 1.649 1.00 36.11 O ATOM 26 CB PRO A 4 -2.289 33.954 4.289 1.00 38.04 C ATOM 27 CG PRO A 4 -1.182 34.927 4.288 1.00 41.70 C ATOM 28 CD PRO A 4 -0.891 35.231 2.834 1.00 38.49 C ATOM 29 N ALA A 5 -3.789 31.472 2.630 1.00 34.20 N ATOM 30 CA ALA A 5 -4.978 30.919 1.989 1.00 31.50 C ATOM 31 C ALA A 5 -5.715 30.014 2.964 1.00 33.64 C ATOM 32 O ALA A 5 -5.200 29.657 4.016 1.00 34.36 O ATOM 33 CB ALA A 5 -4.588 30.155 0.752 1.00 33.29 C ATOM 34 H ALA A 5 -3.265 30.880 3.306 1.00 0.00 H ATOM 35 N ASN A 6 -6.919 29.673 2.614 1.00 29.34 N ATOM 36 CA ASN A 6 -7.744 28.814 3.391 1.00 29.24 C ATOM 37 C ASN A 6 -8.076 27.664 2.436 1.00 29.91 C ATOM 38 O ASN A 6 -8.629 27.938 1.367 1.00 30.86 O ATOM 39 CB ASN A 6 -9.009 29.504 3.759 1.00 30.96 C ATOM 40 CG ASN A 6 -8.776 30.772 4.578 1.00 31.87 C ATOM 41 OD1 ASN A 6 -8.840 30.748 5.795 1.00 32.27 O ATOM 42 ND2 ASN A 6 -8.447 31.852 3.918 1.00 35.52 N ATOM 43 HD22 ASN A 6 -8.403 31.833 2.879 1.00 0.00 H ATOM 44 HD21 ASN A 6 -8.229 32.729 4.432 1.00 0.00 H ATOM 45 H ASN A 6 -7.298 30.047 1.721 1.00 0.00 H ATOM 46 N LYS A 7 -7.823 26.423 2.864 1.00 27.70 N ATOM 47 CA LYS A 7 -8.105 25.283 2.041 1.00 28.91 C ATOM 48 C LYS A 7 -9.382 24.600 2.556 1.00 25.95 C ATOM 49 O LYS A 7 -9.379 23.932 3.631 1.00 28.29 O ATOM 50 CB LYS A 7 -6.907 24.298 2.097 1.00 28.29 C ATOM 51 CG LYS A 7 -7.167 23.062 1.292 1.00 35.51 C ATOM 52 CD LYS A 7 -5.955 22.156 1.292 1.00 37.22 C ATOM 53 CE LYS A 7 -6.332 20.981 0.420 1.00 45.92 C ATOM 54 NZ LYS A 7 -5.231 19.977 0.218 1.00 53.48 N ATOM 55 HZ1 LYS A 7 -4.418 20.442 -0.234 1.00 0.00 H ATOM 56 HZ2 LYS A 7 -4.942 19.591 1.139 1.00 0.00 H ATOM 57 HZ3 LYS A 7 -5.574 19.206 -0.390 1.00 0.00 H ATOM 58 H LYS A 7 -7.415 26.282 3.810 1.00 0.00 H ATOM 59 N LEU A 8 -10.452 24.769 1.815 1.00 27.84 N ATOM 60 CA LEU A 8 -11.735 24.150 2.171 1.00 26.84 C ATOM 61 C LEU A 8 -11.853 22.785 1.466 1.00 28.56 C ATOM 62 O LEU A 8 -11.561 22.672 0.285 1.00 29.99 O ATOM 63 CB LEU A 8 -12.915 25.011 1.733 1.00 29.74 C ATOM 64 CG LEU A 8 -14.270 24.492 2.127 1.00 28.55 C ATOM 65 CD1 LEU A 8 -14.479 24.653 3.597 1.00 30.63 C ATOM 66 CD2 LEU A 8 -15.336 25.266 1.397 1.00 32.73 C ATOM 67 H LEU A 8 -10.390 25.354 0.957 1.00 0.00 H ATOM 68 N VAL A 9 -12.201 21.747 2.210 1.00 27.14 N ATOM 69 CA VAL A 9 -12.421 20.443 1.638 1.00 26.56 C ATOM 70 C VAL A 9 -13.829 20.014 1.875 1.00 27.14 C ATOM 71 O VAL A 9 -14.333 20.052 2.983 1.00 28.13 O ATOM 72 CB VAL A 9 -11.379 19.427 2.261 1.00 26.41 C ATOM 73 CG1 VAL A 9 -11.540 18.079 1.625 1.00 30.66 C ATOM 74 CG2 VAL A 9 -9.917 19.889 2.081 1.00 27.21 C ATOM 75 H VAL A 9 -12.319 21.876 3.235 1.00 0.00 H ATOM 76 N ILE A 10 -14.422 19.446 0.853 1.00 26.84 N ATOM 77 CA ILE A 10 -15.818 18.977 0.911 1.00 29.49 C ATOM 78 C ILE A 10 -15.747 17.538 0.391 1.00 30.40 C ATOM 79 O ILE A 10 -15.324 17.311 -0.748 1.00 32.72 O ATOM 80 CB ILE A 10 -16.732 19.769 -0.006 1.00 29.48 C ATOM 81 CG1 ILE A 10 -16.831 21.261 0.360 1.00 33.41 C ATOM 82 CG2 ILE A 10 -18.112 19.120 -0.022 1.00 33.21 C ATOM 83 CD1 ILE A 10 -17.588 22.065 -0.696 1.00 32.37 C ATOM 84 H ILE A 10 -13.888 19.322 -0.031 1.00 0.00 H ATOM 85 N VAL A 11 -16.187 16.579 1.179 1.00 29.69 N ATOM 86 CA VAL A 11 -16.260 15.209 0.730 1.00 31.70 C ATOM 87 C VAL A 11 -17.716 14.823 0.815 1.00 35.30 C ATOM 88 O VAL A 11 -18.345 14.878 1.872 1.00 34.37 O ATOM 89 CB VAL A 11 -15.430 14.224 1.534 1.00 32.00 C ATOM 90 CG1 VAL A 11 -15.480 12.862 0.827 1.00 32.55 C ATOM 91 CG2 VAL A 11 -13.976 14.706 1.671 1.00 30.61 C ATOM 92 H VAL A 11 -16.489 16.814 2.146 1.00 0.00 H ATOM 93 N THR A 12 -18.285 14.412 -0.313 1.00 35.14 N ATOM 94 CA THR A 12 -19.711 14.154 -0.322 1.00 34.69 C ATOM 95 C THR A 12 -20.121 13.243 -1.461 1.00 37.28 C ATOM 96 O THR A 12 -19.280 12.683 -2.161 1.00 35.70 O ATOM 97 CB THR A 12 -20.497 15.487 -0.345 1.00 36.32 C ATOM 98 OG1 THR A 12 -21.885 15.270 -0.081 1.00 37.27 O ATOM 99 CG2 THR A 12 -20.378 16.130 -1.698 1.00 36.00 C ATOM 100 HG1 THR A 12 -21.989 14.856 0.812 1.00 0.00 H ATOM 101 H THR A 12 -17.717 14.278 -1.174 1.00 0.00 H ATOM 102 N GLU A 13 -21.425 13.095 -1.667 1.00 38.30 N ATOM 103 CA GLU A 13 -21.920 12.128 -2.647 1.00 42.57 C ATOM 104 C GLU A 13 -21.681 12.627 -4.084 1.00 41.95 C ATOM 105 O GLU A 13 -21.859 13.815 -4.381 1.00 42.27 O ATOM 106 CB GLU A 13 -23.383 11.795 -2.380 1.00 44.10 C ATOM 107 CG GLU A 13 -23.628 11.248 -0.978 1.00 44.99 C ATOM 108 CD GLU A 13 -25.025 10.661 -0.774 1.00 50.26 C ATOM 109 OE1 GLU A 13 -25.576 10.085 -1.730 1.00 52.92 O ATOM 110 OE2 GLU A 13 -25.590 10.765 0.346 1.00 49.77 O ATOM 111 H GLU A 13 -22.101 13.672 -1.126 1.00 0.00 H ATOM 112 N LYS A 14 -21.309 11.706 -4.981 1.00 43.59 N ATOM 113 CA LYS A 14 -20.859 12.065 -6.336 1.00 45.43 C ATOM 114 C LYS A 14 -21.962 12.751 -7.138 1.00 48.54 C ATOM 115 O LYS A 14 -21.706 13.640 -7.947 1.00 46.51 O ATOM 116 CB LYS A 14 -20.390 10.792 -7.061 1.00 51.97 C ATOM 117 CG LYS A 14 -19.911 10.925 -8.507 1.00 57.99 C ATOM 118 CD LYS A 14 -20.154 9.614 -9.247 1.00 65.99 C ATOM 119 CE LYS A 14 -19.516 8.377 -8.592 1.00 67.03 C ATOM 120 NZ LYS A 14 -18.154 8.089 -9.152 1.00 67.43 N ATOM 121 HZ1 LYS A 14 -18.231 7.915 -10.174 1.00 0.00 H ATOM 122 HZ2 LYS A 14 -17.532 8.905 -8.984 1.00 0.00 H ATOM 123 HZ3 LYS A 14 -17.759 7.248 -8.684 1.00 0.00 H ATOM 124 H LYS A 14 -21.339 10.702 -4.712 1.00 0.00 H ATOM 125 N ILE A 15 -23.195 12.352 -6.869 1.00 49.45 N ATOM 126 CA ILE A 15 -24.360 12.923 -7.558 1.00 53.15 C ATOM 127 C ILE A 15 -24.405 14.438 -7.389 1.00 49.86 C ATOM 128 O ILE A 15 -24.978 15.128 -8.245 1.00 49.80 O ATOM 129 CB ILE A 15 -25.675 12.245 -7.083 1.00 56.28 C ATOM 130 CG1 ILE A 15 -26.884 12.583 -7.990 1.00 61.35 C ATOM 131 CG2 ILE A 15 -25.942 12.568 -5.619 1.00 55.01 C ATOM 132 CD1 ILE A 15 -28.207 11.943 -7.574 1.00 66.64 C ATOM 133 H ILE A 15 -23.343 11.615 -6.151 1.00 0.00 H ATOM 134 N LEU A 16 -23.784 14.964 -6.327 1.00 48.30 N ATOM 135 CA LEU A 16 -23.803 16.409 -6.077 1.00 44.85 C ATOM 136 C LEU A 16 -22.694 17.216 -6.802 1.00 44.43 C ATOM 137 O LEU A 16 -22.606 18.431 -6.637 1.00 44.64 O ATOM 138 CB LEU A 16 -23.761 16.680 -4.588 1.00 45.23 C ATOM 139 CG LEU A 16 -24.840 16.182 -3.635 1.00 46.08 C ATOM 140 CD1 LEU A 16 -24.526 16.615 -2.199 1.00 44.42 C ATOM 141 CD2 LEU A 16 -26.180 16.736 -4.065 1.00 50.76 C ATOM 142 H LEU A 16 -23.279 14.338 -5.668 1.00 0.00 H ATOM 143 N LEU A 17 -21.868 16.572 -7.621 1.00 45.81 N ATOM 144 CA LEU A 17 -20.742 17.243 -8.262 1.00 43.31 C ATOM 145 C LEU A 17 -21.067 18.596 -8.922 1.00 43.99 C ATOM 146 O LEU A 17 -20.455 19.641 -8.642 1.00 43.08 O ATOM 147 CB LEU A 17 -20.150 16.327 -9.303 1.00 48.68 C ATOM 148 CG LEU A 17 -19.113 16.916 -10.232 1.00 50.39 C ATOM 149 CD1 LEU A 17 -17.833 17.178 -9.529 1.00 49.42 C ATOM 150 CD2 LEU A 17 -18.864 15.936 -11.372 1.00 56.35 C ATOM 151 H LEU A 17 -22.029 15.562 -7.810 1.00 0.00 H ATOM 152 N LYS A 18 -22.037 18.592 -9.809 1.00 47.15 N ATOM 153 CA LYS A 18 -22.393 19.819 -10.496 1.00 48.07 C ATOM 154 C LYS A 18 -23.065 20.867 -9.591 1.00 46.44 C ATOM 155 O LYS A 18 -22.773 22.031 -9.712 1.00 48.72 O ATOM 156 CB LYS A 18 -23.263 19.511 -11.708 1.00 53.69 C ATOM 157 CG LYS A 18 -22.444 19.042 -12.900 1.00 59.10 C ATOM 158 H LYS A 18 -22.548 17.711 -10.018 1.00 0.00 H ATOM 159 N LYS A 19 -23.936 20.464 -8.682 1.00 47.30 N ATOM 160 CA LYS A 19 -24.576 21.388 -7.723 1.00 48.17 C ATOM 161 C LYS A 19 -23.594 22.079 -6.794 1.00 50.04 C ATOM 162 O LYS A 19 -23.732 23.278 -6.446 1.00 47.47 O ATOM 163 CB LYS A 19 -25.623 20.614 -6.903 1.00 49.36 C ATOM 164 CG LYS A 19 -26.959 20.400 -7.656 1.00 56.81 C ATOM 165 CD LYS A 19 -27.832 19.299 -7.068 1.00 59.72 C ATOM 166 CE LYS A 19 -29.093 19.069 -7.913 1.00 66.93 C ATOM 167 NZ LYS A 19 -29.902 17.897 -7.455 1.00 68.51 N ATOM 168 HZ1 LYS A 19 -29.323 17.035 -7.511 1.00 0.00 H ATOM 169 HZ2 LYS A 19 -30.205 18.049 -6.472 1.00 0.00 H ATOM 170 HZ3 LYS A 19 -30.738 17.795 -8.065 1.00 0.00 H ATOM 171 H LYS A 19 -24.181 19.454 -8.640 1.00 0.00 H ATOM 172 N ILE A 20 -22.567 21.338 -6.353 1.00 43.94 N ATOM 173 CA ILE A 20 -21.548 21.977 -5.547 1.00 43.27 C ATOM 174 C ILE A 20 -20.649 22.886 -6.361 1.00 41.83 C ATOM 175 O ILE A 20 -20.330 23.964 -5.876 1.00 41.77 O ATOM 176 CB ILE A 20 -20.784 20.924 -4.705 1.00 41.65 C ATOM 177 CG1 ILE A 20 -21.845 20.361 -3.730 1.00 44.57 C ATOM 178 CG2 ILE A 20 -19.538 21.519 -4.009 1.00 38.40 C ATOM 179 CD1 ILE A 20 -21.350 19.187 -2.915 1.00 44.84 C ATOM 180 H ILE A 20 -22.504 20.326 -6.585 1.00 0.00 H ATOM 181 N ALA A 21 -20.220 22.467 -7.550 1.00 43.54 N ATOM 182 CA ALA A 21 -19.370 23.291 -8.407 1.00 45.12 C ATOM 183 C ALA A 21 -20.029 24.639 -8.728 1.00 47.73 C ATOM 184 O ALA A 21 -19.333 25.634 -8.787 1.00 46.98 O ATOM 185 CB ALA A 21 -19.071 22.565 -9.704 1.00 49.10 C ATOM 186 H ALA A 21 -20.499 21.521 -7.880 1.00 0.00 H ATOM 187 N LYS A 22 -21.352 24.645 -8.929 1.00 51.93 N ATOM 188 CA LYS A 22 -22.115 25.893 -9.151 1.00 52.89 C ATOM 189 C LYS A 22 -21.998 26.819 -7.958 1.00 53.68 C ATOM 190 O LYS A 22 -21.739 28.025 -8.102 1.00 52.34 O ATOM 191 CB LYS A 22 -23.618 25.624 -9.460 1.00 55.21 C ATOM 192 H LYS A 22 -21.863 23.739 -8.929 1.00 0.00 H ATOM 193 N ILE A 23 -22.154 26.260 -6.764 1.00 52.59 N ATOM 194 CA ILE A 23 -21.979 27.040 -5.539 1.00 47.98 C ATOM 195 C ILE A 23 -20.558 27.607 -5.350 1.00 46.64 C ATOM 196 O ILE A 23 -20.385 28.766 -4.992 1.00 43.81 O ATOM 197 CB ILE A 23 -22.382 26.209 -4.310 1.00 46.22 C ATOM 198 CG1 ILE A 23 -23.893 25.972 -4.279 1.00 50.65 C ATOM 199 CG2 ILE A 23 -21.933 26.872 -3.026 1.00 45.99 C ATOM 200 CD1 ILE A 23 -24.321 24.871 -3.319 1.00 48.58 C ATOM 201 H ILE A 23 -22.404 25.253 -6.699 1.00 0.00 H ATOM 202 N ILE A 24 -19.530 26.782 -5.550 1.00 42.66 N ATOM 203 CA ILE A 24 -18.164 27.290 -5.505 1.00 40.45 C ATOM 204 C ILE A 24 -17.942 28.528 -6.429 1.00 43.91 C ATOM 205 O ILE A 24 -17.466 29.586 -5.989 1.00 45.60 O ATOM 206 CB ILE A 24 -17.201 26.150 -5.837 1.00 37.55 C ATOM 207 CG1 ILE A 24 -17.301 25.059 -4.735 1.00 35.62 C ATOM 208 CG2 ILE A 24 -15.775 26.676 -5.905 1.00 35.68 C ATOM 209 CD1 ILE A 24 -16.597 23.782 -5.115 1.00 37.60 C ATOM 210 H ILE A 24 -19.703 25.774 -5.739 1.00 0.00 H ATOM 211 N ASP A 25 -18.303 28.376 -7.695 1.00 47.62 N ATOM 212 CA ASP A 25 -18.251 29.490 -8.640 1.00 56.30 C ATOM 213 C ASP A 25 -19.035 30.729 -8.148 1.00 56.31 C ATOM 214 O ASP A 25 -18.496 31.846 -8.162 1.00 54.51 O ATOM 215 CB ASP A 25 -18.763 29.070 -10.021 1.00 59.86 C ATOM 216 CG ASP A 25 -17.964 27.904 -10.624 1.00 63.36 C ATOM 217 OD1 ASP A 25 -16.735 27.725 -10.320 1.00 62.45 O ATOM 218 OD2 ASP A 25 -18.583 27.149 -11.410 1.00 62.35 O ATOM 219 H ASP A 25 -18.630 27.445 -8.023 1.00 0.00 H ATOM 220 N GLU A 26 -20.255 30.535 -7.654 1.00 54.69 N ATOM 221 CA GLU A 26 -21.067 31.673 -7.172 1.00 57.82 C ATOM 222 C GLU A 26 -20.502 32.399 -5.938 1.00 55.42 C ATOM 223 O GLU A 26 -20.883 33.541 -5.656 1.00 50.14 O ATOM 224 CB GLU A 26 -22.546 31.249 -6.936 1.00 61.79 C ATOM 225 CG GLU A 26 -23.321 30.889 -8.207 1.00 63.10 C ATOM 226 CD GLU A 26 -24.653 30.176 -7.949 1.00 66.96 C ATOM 227 OE1 GLU A 26 -24.848 29.583 -6.879 1.00 70.16 O ATOM 228 OE2 GLU A 26 -25.520 30.186 -8.836 1.00 66.69 O ATOM 229 H GLU A 26 -20.642 29.571 -7.606 1.00 0.00 H ATOM 230 N SER A 27 -19.593 31.752 -5.204 1.00 51.64 N ATOM 231 CA SER A 27 -19.024 32.319 -3.998 1.00 49.05 C ATOM 232 C SER A 27 -17.962 33.345 -4.313 1.00 47.94 C ATOM 233 O SER A 27 -17.567 34.065 -3.406 1.00 49.59 O ATOM 234 CB SER A 27 -18.314 31.249 -3.173 1.00 47.41 C ATOM 235 OG SER A 27 -17.160 30.801 -3.901 1.00 48.00 O ATOM 236 HG SER A 27 -17.446 30.423 -4.770 1.00 0.00 H ATOM 237 H SER A 27 -19.282 30.807 -5.509 1.00 0.00 H ATOM 238 N GLY A 28 -17.465 33.367 -5.552 1.00 45.57 N ATOM 239 CA GLY A 28 -16.259 34.149 -5.891 1.00 44.71 C ATOM 240 C GLY A 28 -14.905 33.445 -5.828 1.00 41.71 C ATOM 241 O GLY A 28 -13.849 34.055 -6.076 1.00 40.30 O ATOM 242 H GLY A 28 -17.940 32.819 -6.298 1.00 0.00 H ATOM 243 N ALA A 29 -14.870 32.176 -5.446 1.00 40.14 N ATOM 244 CA ALA A 29 -13.624 31.439 -5.436 1.00 37.05 C ATOM 245 C ALA A 29 -13.010 31.416 -6.825 1.00 36.34 C ATOM 246 O ALA A 29 -13.744 31.433 -7.823 1.00 37.83 O ATOM 247 CB ALA A 29 -13.845 30.036 -4.930 1.00 34.33 C ATOM 248 H ALA A 29 -15.748 31.704 -5.150 1.00 0.00 H ATOM 249 N LYS A 30 -11.691 31.422 -6.919 1.00 36.31 N ATOM 250 CA LYS A 30 -11.013 31.555 -8.223 1.00 39.70 C ATOM 251 C LYS A 30 -10.873 30.250 -8.950 1.00 38.56 C ATOM 252 O LYS A 30 -10.605 30.210 -10.152 1.00 41.12 O ATOM 253 CB LYS A 30 -9.645 32.184 -8.068 1.00 41.60 C ATOM 254 CG LYS A 30 -9.661 33.544 -7.392 1.00 44.52 C ATOM 255 CD LYS A 30 -10.295 34.637 -8.196 1.00 49.79 C ATOM 256 CE LYS A 30 -9.976 35.941 -7.487 1.00 49.90 C ATOM 257 NZ LYS A 30 -10.716 36.981 -8.178 1.00 56.19 N ATOM 258 HZ1 LYS A 30 -10.415 37.016 -9.173 1.00 0.00 H ATOM 259 HZ2 LYS A 30 -11.733 36.771 -8.129 1.00 0.00 H ATOM 260 HZ3 LYS A 30 -10.528 37.898 -7.725 1.00 0.00 H ATOM 261 H LYS A 30 -11.119 31.331 -6.055 1.00 0.00 H ATOM 262 N GLY A 31 -11.133 29.176 -8.257 1.00 38.36 N ATOM 263 CA GLY A 31 -11.076 27.826 -8.864 1.00 37.45 C ATOM 264 C GLY A 31 -11.204 26.743 -7.794 1.00 34.86 C ATOM 265 O GLY A 31 -11.441 27.038 -6.619 1.00 35.22 O ATOM 266 H GLY A 31 -11.387 29.270 -7.253 1.00 0.00 H ATOM 267 N TYR A 32 -11.157 25.501 -8.246 1.00 32.78 N ATOM 268 CA TYR A 32 -11.268 24.353 -7.386 1.00 32.71 C ATOM 269 C TYR A 32 -10.652 23.159 -8.067 1.00 31.60 C ATOM 270 O TYR A 32 -10.511 23.105 -9.296 1.00 33.75 O ATOM 271 CB TYR A 32 -12.753 24.087 -7.005 1.00 33.40 C ATOM 272 CG TYR A 32 -13.668 23.711 -8.143 1.00 33.14 C ATOM 273 CD1 TYR A 32 -14.317 24.702 -8.890 1.00 38.26 C ATOM 274 CD2 TYR A 32 -13.869 22.378 -8.511 1.00 34.73 C ATOM 275 CE1 TYR A 32 -15.113 24.357 -9.957 1.00 40.68 C ATOM 276 CE2 TYR A 32 -14.665 22.050 -9.555 1.00 38.95 C ATOM 277 CZ TYR A 32 -15.298 23.033 -10.261 1.00 40.84 C ATOM 278 OH TYR A 32 -16.074 22.726 -11.348 1.00 45.85 O ATOM 279 HH TYR A 32 -16.449 23.559 -11.730 1.00 0.00 H ATOM 280 H TYR A 32 -11.035 25.348 -9.267 1.00 0.00 H ATOM 281 N THR A 33 -10.354 22.154 -7.221 1.00 28.23 N ATOM 282 CA THR A 33 -9.918 20.877 -7.624 1.00 32.59 C ATOM 283 C THR A 33 -10.940 19.866 -7.148 1.00 33.00 C ATOM 284 O THR A 33 -11.479 19.985 -6.063 1.00 32.15 O ATOM 285 CB THR A 33 -8.528 20.613 -7.005 1.00 34.12 C ATOM 286 OG1 THR A 33 -7.631 21.649 -7.499 1.00 35.82 O ATOM 287 CG2 THR A 33 -7.998 19.252 -7.458 1.00 35.89 C ATOM 288 HG1 THR A 33 -7.972 22.537 -7.224 1.00 0.00 H ATOM 289 H THR A 33 -10.453 22.333 -6.201 1.00 0.00 H ATOM 290 N VAL A 34 -11.203 18.883 -7.957 1.00 29.14 N ATOM 291 CA VAL A 34 -12.176 17.844 -7.588 1.00 31.96 C ATOM 292 C VAL A 34 -11.592 16.499 -7.929 1.00 33.11 C ATOM 293 O VAL A 34 -10.786 16.385 -8.869 1.00 33.75 O ATOM 294 CB VAL A 34 -13.607 18.108 -8.142 1.00 35.41 C ATOM 295 CG1 VAL A 34 -13.594 18.057 -9.634 1.00 40.43 C ATOM 296 CG2 VAL A 34 -14.635 17.100 -7.605 1.00 37.91 C ATOM 297 H VAL A 34 -10.719 18.831 -8.876 1.00 0.00 H ATOM 298 N MET A 35 -11.931 15.453 -7.154 1.00 30.78 N ATOM 299 CA MET A 35 -11.396 14.152 -7.480 1.00 32.65 C ATOM 300 C MET A 35 -12.326 13.068 -7.056 1.00 32.59 C ATOM 301 O MET A 35 -13.101 13.286 -6.183 1.00 31.10 O ATOM 302 CB MET A 35 -10.018 14.013 -6.891 1.00 36.84 C ATOM 303 CG MET A 35 -9.998 13.954 -5.413 1.00 38.37 C ATOM 304 SD MET A 35 -8.474 14.736 -4.745 1.00 50.27 S ATOM 305 CE MET A 35 -9.165 16.421 -4.804 1.00 43.12 C ATOM 306 H MET A 35 -12.564 15.579 -6.338 1.00 0.00 H ATOM 307 N ASN A 36 -12.228 11.926 -7.697 1.00 32.07 N ATOM 308 CA ASN A 36 -13.056 10.772 -7.352 1.00 36.82 C ATOM 309 C ASN A 36 -12.384 10.064 -6.205 1.00 35.71 C ATOM 310 O ASN A 36 -11.210 9.742 -6.304 1.00 37.93 O ATOM 311 CB ASN A 36 -13.123 9.817 -8.445 1.00 40.39 C ATOM 312 CG ASN A 36 -13.887 10.372 -9.597 1.00 46.63 C ATOM 313 OD1 ASN A 36 -14.963 10.924 -9.411 1.00 41.58 O ATOM 314 ND2 ASN A 36 -13.308 10.293 -10.759 1.00 51.60 N ATOM 315 HD22 ASN A 36 -12.392 9.810 -10.852 1.00 0.00 H ATOM 316 HD21 ASN A 36 -13.761 10.713 -11.595 1.00 0.00 H ATOM 317 H ASN A 36 -11.541 11.840 -8.473 1.00 0.00 H ATOM 318 N THR A 37 -13.165 9.843 -5.154 1.00 34.34 N ATOM 319 CA THR A 37 -12.695 9.167 -3.949 1.00 32.77 C ATOM 320 C THR A 37 -13.643 8.075 -3.525 1.00 33.85 C ATOM 321 O THR A 37 -14.627 7.766 -4.202 1.00 35.69 O ATOM 322 CB THR A 37 -12.572 10.237 -2.833 1.00 30.36 C ATOM 323 OG1 THR A 37 -13.826 10.943 -2.643 1.00 33.25 O ATOM 324 CG2 THR A 37 -11.517 11.191 -3.145 1.00 31.30 C ATOM 325 HG1 THR A 37 -14.531 10.297 -2.386 1.00 0.00 H ATOM 326 H THR A 37 -14.153 10.165 -5.191 1.00 0.00 H ATOM 327 N GLY A 38 -13.306 7.364 -2.463 1.00 30.77 N ATOM 328 CA GLY A 38 -14.130 6.338 -1.862 1.00 32.69 C ATOM 329 C GLY A 38 -14.254 6.715 -0.428 1.00 35.44 C ATOM 330 O GLY A 38 -13.358 7.371 0.137 1.00 31.95 O ATOM 331 H GLY A 38 -12.381 7.556 -2.028 1.00 0.00 H ATOM 332 N GLY A 39 -15.381 6.436 0.143 1.00 39.01 N ATOM 333 CA GLY A 39 -15.612 6.862 1.515 1.00 42.43 C ATOM 334 C GLY A 39 -16.378 5.848 2.317 1.00 42.58 C ATOM 335 O GLY A 39 -17.193 5.058 1.771 1.00 42.76 O ATOM 336 H GLY A 39 -16.115 5.912 -0.374 1.00 0.00 H ATOM 337 N LYS A 40 -16.096 5.838 3.614 1.00 40.82 N ATOM 338 CA LYS A 40 -16.917 5.147 4.625 1.00 49.10 C ATOM 339 C LYS A 40 -17.276 6.209 5.707 1.00 47.31 C ATOM 340 O LYS A 40 -16.473 7.094 6.064 1.00 43.28 O ATOM 341 CB LYS A 40 -16.088 3.979 5.169 1.00 51.31 C ATOM 342 CG LYS A 40 -16.763 3.013 6.101 1.00 56.54 C ATOM 343 CD LYS A 40 -16.699 3.453 7.546 1.00 62.52 C ATOM 344 CE LYS A 40 -17.022 2.306 8.507 1.00 68.95 C ATOM 345 NZ LYS A 40 -16.923 2.900 9.875 1.00 73.63 N ATOM 346 HZ1 LYS A 40 -15.961 3.265 10.024 1.00 0.00 H ATOM 347 HZ2 LYS A 40 -17.607 3.678 9.964 1.00 0.00 H ATOM 348 HZ3 LYS A 40 -17.132 2.169 10.585 1.00 0.00 H ATOM 349 H LYS A 40 -15.248 6.347 3.935 1.00 0.00 H ATOM 350 N GLY A 41 -18.511 6.191 6.213 1.00 50.65 N ATOM 351 CA GLY A 41 -18.913 7.224 7.187 1.00 52.35 C ATOM 352 C GLY A 41 -20.351 7.028 7.662 1.00 57.74 C ATOM 353 O GLY A 41 -20.604 6.036 8.326 1.00 65.81 O ATOM 354 H GLY A 41 -19.185 5.454 5.923 1.00 0.00 H TER 355 GLY A 41 ATOM 356 N SER A 54 -15.699 -2.233 0.475 1.00 72.06 N ATOM 357 CA SER A 54 -16.774 -3.202 0.802 1.00 78.28 C ATOM 358 C SER A 54 -17.954 -2.387 1.326 1.00 80.68 C ATOM 359 O SER A 54 -19.019 -2.400 0.709 1.00 82.16 O ATOM 360 CB SER A 54 -16.332 -4.266 1.819 1.00 79.88 C ATOM 361 HN3 SER A 54 -15.435 -1.708 1.333 1.00 0.00 H ATOM 362 HN2 SER A 54 -16.041 -1.569 -0.248 1.00 0.00 H ATOM 363 HN1 SER A 54 -14.870 -2.746 0.112 1.00 0.00 H ATOM 364 N ASP A 55 -17.759 -1.665 2.441 1.00 78.44 N ATOM 365 CA ASP A 55 -18.660 -0.527 2.789 1.00 76.42 C ATOM 366 C ASP A 55 -18.103 0.836 2.263 1.00 65.62 C ATOM 367 O ASP A 55 -18.592 1.905 2.643 1.00 60.56 O ATOM 368 CB ASP A 55 -19.092 -0.499 4.298 1.00 83.11 C ATOM 369 CG ASP A 55 -17.913 -0.419 5.298 1.00 88.96 C ATOM 370 OD1 ASP A 55 -16.883 0.220 5.005 1.00 92.71 O ATOM 371 OD2 ASP A 55 -18.043 -0.980 6.412 1.00 91.40 O ATOM 372 H ASP A 55 -16.967 -1.902 3.072 1.00 0.00 H ATOM 373 N ILE A 56 -17.087 0.776 1.382 1.00 57.28 N ATOM 374 CA ILE A 56 -16.589 1.963 0.669 1.00 50.45 C ATOM 375 C ILE A 56 -17.529 2.233 -0.505 1.00 48.29 C ATOM 376 O ILE A 56 -17.834 1.316 -1.279 1.00 51.12 O ATOM 377 CB ILE A 56 -15.139 1.765 0.182 1.00 51.73 C ATOM 378 CG1 ILE A 56 -14.204 1.695 1.409 1.00 52.40 C ATOM 379 CG2 ILE A 56 -14.718 2.933 -0.696 1.00 47.49 C ATOM 380 CD1 ILE A 56 -12.809 1.150 1.128 1.00 55.68 C ATOM 381 H ILE A 56 -16.637 -0.144 1.198 1.00 0.00 H ATOM 382 N GLU A 57 -18.049 3.445 -0.541 1.00 48.72 N ATOM 383 CA GLU A 57 -18.913 3.925 -1.624 1.00 54.25 C ATOM 384 C GLU A 57 -18.169 5.025 -2.384 1.00 46.62 C ATOM 385 O GLU A 57 -17.442 5.831 -1.804 1.00 42.61 O ATOM 386 CB GLU A 57 -20.247 4.457 -1.073 1.00 60.37 C ATOM 387 CG GLU A 57 -21.139 3.403 -0.379 1.00 69.45 C ATOM 388 CD GLU A 57 -21.610 2.266 -1.295 1.00 77.41 C ATOM 389 OE1 GLU A 57 -21.362 2.343 -2.516 1.00 83.10 O ATOM 390 OE2 GLU A 57 -22.230 1.279 -0.805 1.00 83.04 O ATOM 391 H GLU A 57 -17.834 4.095 0.242 1.00 0.00 H ATOM 392 N ALA A 58 -18.377 5.058 -3.692 1.00 44.82 N ATOM 393 CA ALA A 58 -17.686 5.976 -4.573 1.00 43.18 C ATOM 394 C ALA A 58 -18.233 7.310 -4.230 1.00 42.03 C ATOM 395 O ALA A 58 -19.444 7.470 -4.071 1.00 46.45 O ATOM 396 CB ALA A 58 -17.978 5.622 -6.044 1.00 45.45 C ATOM 397 H ALA A 58 -19.066 4.396 -4.103 1.00 0.00 H ATOM 398 N ASN A 59 -17.368 8.296 -4.077 1.00 35.91 N ATOM 399 CA ASN A 59 -17.782 9.625 -3.745 1.00 36.03 C ATOM 400 C ASN A 59 -16.837 10.668 -4.352 1.00 30.83 C ATOM 401 O ASN A 59 -16.056 10.313 -5.266 1.00 32.88 O ATOM 402 CB ASN A 59 -18.111 9.790 -2.262 1.00 38.15 C ATOM 403 CG ASN A 59 -16.931 9.621 -1.373 1.00 40.36 C ATOM 404 OD1 ASN A 59 -15.772 9.493 -1.848 1.00 39.05 O ATOM 405 ND2 ASN A 59 -17.207 9.539 -0.049 1.00 41.46 N ATOM 406 HD22 ASN A 59 -18.185 9.653 0.286 1.00 0.00 H ATOM 407 HD21 ASN A 59 -16.441 9.362 0.632 1.00 0.00 H ATOM 408 H ASN A 59 -16.354 8.101 -4.202 1.00 0.00 H ATOM 409 N ILE A 60 -16.983 11.917 -3.988 1.00 30.56 N ATOM 410 CA ILE A 60 -16.150 12.996 -4.509 1.00 32.41 C ATOM 411 C ILE A 60 -15.612 13.905 -3.430 1.00 32.17 C ATOM 412 O ILE A 60 -16.248 14.088 -2.387 1.00 31.12 O ATOM 413 CB ILE A 60 -16.859 13.886 -5.561 1.00 36.25 C ATOM 414 CG1 ILE A 60 -18.129 14.453 -5.014 1.00 36.09 C ATOM 415 CG2 ILE A 60 -17.050 13.083 -6.831 1.00 38.73 C ATOM 416 CD1 ILE A 60 -18.806 15.342 -6.018 1.00 40.50 C ATOM 417 H ILE A 60 -17.725 12.150 -3.298 1.00 0.00 H ATOM 418 N LYS A 61 -14.438 14.436 -3.702 1.00 30.28 N ATOM 419 CA LYS A 61 -13.763 15.384 -2.856 1.00 30.91 C ATOM 420 C LYS A 61 -13.405 16.641 -3.669 1.00 31.50 C ATOM 421 O LYS A 61 -12.775 16.545 -4.724 1.00 31.46 O ATOM 422 CB LYS A 61 -12.514 14.736 -2.284 1.00 26.80 C ATOM 423 CG LYS A 61 -11.679 15.720 -1.480 1.00 30.53 C ATOM 424 CD LYS A 61 -10.422 14.967 -0.972 1.00 36.60 C ATOM 425 CE LYS A 61 -9.454 15.817 -0.184 1.00 45.73 C ATOM 426 NZ LYS A 61 -8.113 15.127 -0.074 1.00 46.54 N ATOM 427 HZ1 LYS A 61 -8.233 14.214 0.409 1.00 0.00 H ATOM 428 HZ2 LYS A 61 -7.727 14.969 -1.027 1.00 0.00 H ATOM 429 HZ3 LYS A 61 -7.460 15.726 0.471 1.00 0.00 H ATOM 430 H LYS A 61 -13.968 14.152 -4.585 1.00 0.00 H ATOM 431 N PHE A 62 -13.811 17.785 -3.120 1.00 28.86 N ATOM 432 CA PHE A 62 -13.456 19.102 -3.624 1.00 28.90 C ATOM 433 C PHE A 62 -12.466 19.729 -2.699 1.00 30.20 C ATOM 434 O PHE A 62 -12.554 19.576 -1.422 1.00 29.73 O ATOM 435 CB PHE A 62 -14.624 20.059 -3.632 1.00 32.74 C ATOM 436 CG PHE A 62 -15.696 19.742 -4.630 1.00 32.98 C ATOM 437 CD1 PHE A 62 -16.738 18.918 -4.291 1.00 34.49 C ATOM 438 CD2 PHE A 62 -15.712 20.401 -5.842 1.00 34.17 C ATOM 439 CE1 PHE A 62 -17.761 18.688 -5.167 1.00 36.21 C ATOM 440 CE2 PHE A 62 -16.715 20.177 -6.744 1.00 37.52 C ATOM 441 CZ PHE A 62 -17.751 19.314 -6.406 1.00 37.62 C ATOM 442 H PHE A 62 -14.420 17.733 -2.278 1.00 0.00 H ATOM 443 N GLU A 63 -11.518 20.432 -3.287 1.00 29.01 N ATOM 444 CA GLU A 63 -10.593 21.264 -2.536 1.00 29.80 C ATOM 445 C GLU A 63 -10.679 22.609 -3.129 1.00 28.17 C ATOM 446 O GLU A 63 -10.466 22.765 -4.347 1.00 29.62 O ATOM 447 CB GLU A 63 -9.141 20.746 -2.656 1.00 31.49 C ATOM 448 CG GLU A 63 -8.992 19.390 -2.062 1.00 32.48 C ATOM 449 CD GLU A 63 -7.629 18.763 -2.313 1.00 37.96 C ATOM 450 OE1 GLU A 63 -6.986 18.942 -3.376 1.00 39.82 O ATOM 451 OE2 GLU A 63 -7.255 17.992 -1.441 1.00 40.84 O ATOM 452 H GLU A 63 -11.429 20.390 -4.322 1.00 0.00 H ATOM 453 N ILE A 64 -10.890 23.584 -2.289 1.00 27.20 N ATOM 454 CA ILE A 64 -11.048 24.980 -2.729 1.00 29.69 C ATOM 455 C ILE A 64 -10.158 25.904 -1.890 1.00 31.17 C ATOM 456 O ILE A 64 -10.353 25.991 -0.681 1.00 31.28 O ATOM 457 CB ILE A 64 -12.510 25.477 -2.618 1.00 28.79 C ATOM 458 CG1 ILE A 64 -13.524 24.573 -3.283 1.00 31.88 C ATOM 459 CG2 ILE A 64 -12.692 26.826 -3.295 1.00 30.93 C ATOM 460 CD1 ILE A 64 -14.269 23.637 -2.372 1.00 32.52 C ATOM 461 H ILE A 64 -10.949 23.368 -1.273 1.00 0.00 H ATOM 462 N LEU A 65 -9.196 26.590 -2.527 1.00 29.23 N ATOM 463 CA LEU A 65 -8.355 27.585 -1.865 1.00 31.20 C ATOM 464 C LEU A 65 -8.999 28.945 -1.975 1.00 31.49 C ATOM 465 O LEU A 65 -9.327 29.383 -3.122 1.00 32.02 O ATOM 466 CB LEU A 65 -6.971 27.674 -2.524 1.00 31.65 C ATOM 467 CG LEU A 65 -6.004 26.528 -2.248 1.00 33.12 C ATOM 468 CD1 LEU A 65 -4.860 26.658 -3.221 1.00 35.27 C ATOM 469 CD2 LEU A 65 -5.519 26.593 -0.802 1.00 33.88 C ATOM 470 H LEU A 65 -9.042 26.405 -3.539 1.00 0.00 H ATOM 471 N THR A 66 -9.191 29.644 -0.825 1.00 28.72 N ATOM 472 CA THR A 66 -9.818 30.965 -0.829 1.00 30.43 C ATOM 473 C THR A 66 -8.906 31.924 -0.115 1.00 31.73 C ATOM 474 O THR A 66 -8.184 31.533 0.805 1.00 30.85 O ATOM 475 CB THR A 66 -11.219 31.006 -0.184 1.00 31.89 C ATOM 476 OG1 THR A 66 -11.088 30.670 1.204 1.00 32.00 O ATOM 477 CG2 THR A 66 -12.136 29.994 -0.867 1.00 34.30 C ATOM 478 HG1 THR A 66 -10.492 31.325 1.646 1.00 0.00 H ATOM 479 H THR A 66 -8.885 29.230 0.078 1.00 0.00 H ATOM 480 N GLU A 67 -8.976 33.186 -0.527 1.00 32.31 N ATOM 481 CA GLU A 67 -8.125 34.242 0.031 1.00 35.63 C ATOM 482 C GLU A 67 -8.609 34.531 1.457 1.00 37.57 C ATOM 483 O GLU A 67 -7.786 34.843 2.310 1.00 37.09 O ATOM 484 CB GLU A 67 -8.225 35.496 -0.837 1.00 40.64 C ATOM 485 CG GLU A 67 -7.679 36.740 -0.189 1.00 50.27 C ATOM 486 CD GLU A 67 -7.863 37.976 -1.077 1.00 54.69 C ATOM 487 OE1 GLU A 67 -6.865 38.339 -1.744 1.00 61.20 O ATOM 488 OE2 GLU A 67 -8.995 38.554 -1.103 1.00 55.29 O ATOM 489 H GLU A 67 -9.659 33.433 -1.272 1.00 0.00 H ATOM 490 N THR A 68 -9.930 34.406 1.699 1.00 32.77 N ATOM 491 CA THR A 68 -10.480 34.776 3.004 1.00 34.24 C ATOM 492 C THR A 68 -11.177 33.579 3.626 1.00 33.31 C ATOM 493 O THR A 68 -11.694 32.669 2.951 1.00 32.36 O ATOM 494 CB THR A 68 -11.493 35.927 2.898 1.00 37.00 C ATOM 495 OG1 THR A 68 -12.672 35.459 2.211 1.00 36.19 O ATOM 496 CG2 THR A 68 -10.914 37.154 2.232 1.00 35.74 C ATOM 497 HG1 THR A 68 -13.327 36.198 2.141 1.00 0.00 H ATOM 498 H THR A 68 -10.561 34.045 0.955 1.00 0.00 H ATOM 499 N ARG A 69 -11.232 33.597 4.959 1.00 34.16 N ATOM 500 CA ARG A 69 -11.947 32.568 5.675 1.00 34.09 C ATOM 501 C ARG A 69 -13.463 32.656 5.448 1.00 32.45 C ATOM 502 O ARG A 69 -14.133 31.635 5.317 1.00 34.66 O ATOM 503 CB ARG A 69 -11.674 32.733 7.183 1.00 34.61 C ATOM 504 CG ARG A 69 -12.446 31.801 8.126 1.00 36.85 C ATOM 505 CD ARG A 69 -11.954 30.365 8.068 1.00 36.29 C ATOM 506 NE ARG A 69 -12.598 29.585 9.088 1.00 35.74 N ATOM 507 CZ ARG A 69 -12.013 28.718 9.918 1.00 35.10 C ATOM 508 NH1 ARG A 69 -10.730 28.424 9.776 1.00 36.38 N ATOM 509 NH2 ARG A 69 -12.740 28.121 10.821 1.00 36.20 N ATOM 510 HE ARG A 69 -13.626 29.708 9.191 1.00 0.00 H ATOM 511 HH12 ARG A 69 -10.277 27.748 10.424 1.00 0.00 H ATOM 512 HH11 ARG A 69 -10.176 28.869 9.017 1.00 0.00 H ATOM 513 HH22 ARG A 69 -12.302 27.443 11.476 1.00 0.00 H ATOM 514 HH21 ARG A 69 -13.758 28.323 10.886 1.00 0.00 H ATOM 515 H ARG A 69 -10.757 34.358 5.485 1.00 0.00 H ATOM 516 N GLU A 70 -14.013 33.853 5.387 1.00 32.09 N ATOM 517 CA GLU A 70 -15.470 34.015 5.211 1.00 35.43 C ATOM 518 C GLU A 70 -15.944 33.431 3.857 1.00 35.67 C ATOM 519 O GLU A 70 -17.052 32.882 3.783 1.00 36.28 O ATOM 520 CB GLU A 70 -15.942 35.435 5.387 1.00 38.21 C ATOM 521 CG GLU A 70 -15.394 36.453 4.397 1.00 39.76 C ATOM 522 CD GLU A 70 -15.964 37.835 4.487 1.00 41.40 C ATOM 523 OE1 GLU A 70 -15.371 38.652 3.748 1.00 42.54 O ATOM 524 OE2 GLU A 70 -16.944 38.163 5.233 1.00 42.23 O ATOM 525 H GLU A 70 -13.410 34.697 5.464 1.00 0.00 H ATOM 526 N MET A 71 -15.116 33.544 2.832 1.00 35.55 N ATOM 527 CA MET A 71 -15.485 32.944 1.521 1.00 36.26 C ATOM 528 C MET A 71 -15.568 31.424 1.580 1.00 35.71 C ATOM 529 O MET A 71 -16.532 30.821 1.091 1.00 34.08 O ATOM 530 CB MET A 71 -14.551 33.391 0.397 1.00 36.77 C ATOM 531 CG MET A 71 -14.941 32.823 -0.959 1.00 40.62 C ATOM 532 SD MET A 71 -13.772 33.309 -2.237 1.00 41.72 S ATOM 533 CE MET A 71 -14.295 34.935 -2.579 1.00 46.94 C ATOM 534 H MET A 71 -14.213 34.049 2.941 1.00 0.00 H ATOM 535 N ALA A 72 -14.598 30.819 2.262 1.00 33.09 N ATOM 536 CA ALA A 72 -14.624 29.390 2.489 1.00 31.90 C ATOM 537 C ALA A 72 -15.828 28.988 3.313 1.00 33.36 C ATOM 538 O ALA A 72 -16.502 28.035 2.958 1.00 33.65 O ATOM 539 CB ALA A 72 -13.310 28.959 3.128 1.00 31.45 C ATOM 540 H ALA A 72 -13.809 31.382 2.638 1.00 0.00 H ATOM 541 N GLU A 73 -16.182 29.751 4.343 1.00 30.94 N ATOM 542 CA GLU A 73 -17.284 29.384 5.167 1.00 34.46 C ATOM 543 C GLU A 73 -18.624 29.600 4.440 1.00 37.14 C ATOM 544 O GLU A 73 -19.567 28.897 4.720 1.00 37.87 O ATOM 545 CB GLU A 73 -17.255 30.148 6.503 1.00 36.46 C ATOM 546 CG GLU A 73 -16.024 29.750 7.358 1.00 37.27 C ATOM 547 CD GLU A 73 -16.213 29.995 8.818 1.00 40.77 C ATOM 548 OE1 GLU A 73 -17.375 30.018 9.254 1.00 43.51 O ATOM 549 OE2 GLU A 73 -15.241 30.238 9.566 1.00 41.58 O ATOM 550 H GLU A 73 -15.651 30.621 4.548 1.00 0.00 H ATOM 551 N GLU A 74 -18.686 30.571 3.538 1.00 36.81 N ATOM 552 CA GLU A 74 -19.903 30.814 2.779 1.00 40.50 C ATOM 553 C GLU A 74 -20.171 29.573 1.893 1.00 38.04 C ATOM 554 O GLU A 74 -21.303 29.144 1.783 1.00 40.90 O ATOM 555 CB GLU A 74 -19.806 32.115 1.947 1.00 45.54 C ATOM 556 CG GLU A 74 -20.557 31.955 0.626 1.00 56.27 C ATOM 557 CD GLU A 74 -20.917 33.229 -0.118 1.00 62.99 C ATOM 558 OE1 GLU A 74 -21.751 33.117 -1.060 1.00 72.60 O ATOM 559 OE2 GLU A 74 -20.407 34.309 0.238 1.00 63.96 O ATOM 560 H GLU A 74 -17.851 31.168 3.371 1.00 0.00 H ATOM 561 N ILE A 75 -19.152 29.052 1.237 1.00 34.25 N ATOM 562 CA ILE A 75 -19.264 27.829 0.424 1.00 36.70 C ATOM 563 C ILE A 75 -19.726 26.689 1.321 1.00 37.73 C ATOM 564 O ILE A 75 -20.737 26.035 1.011 1.00 37.32 O ATOM 565 CB ILE A 75 -17.951 27.454 -0.196 1.00 35.28 C ATOM 566 CG1 ILE A 75 -17.508 28.553 -1.185 1.00 39.09 C ATOM 567 CG2 ILE A 75 -18.033 26.101 -0.915 1.00 35.43 C ATOM 568 CD1 ILE A 75 -16.093 28.361 -1.646 1.00 37.99 C ATOM 569 H ILE A 75 -18.228 29.526 1.297 1.00 0.00 H ATOM 570 N ALA A 76 -19.028 26.541 2.454 1.00 34.82 N ATOM 571 CA ALA A 76 -19.328 25.498 3.419 1.00 38.22 C ATOM 572 C ALA A 76 -20.797 25.583 3.866 1.00 36.66 C ATOM 573 O ALA A 76 -21.524 24.583 3.791 1.00 36.52 O ATOM 574 CB ALA A 76 -18.398 25.574 4.659 1.00 37.27 C ATOM 575 H ALA A 76 -18.244 27.196 2.650 1.00 0.00 H ATOM 576 N ASP A 77 -21.220 26.756 4.328 1.00 39.36 N ATOM 577 CA ASP A 77 -22.576 26.983 4.863 1.00 41.44 C ATOM 578 C ASP A 77 -23.652 26.709 3.813 1.00 41.69 C ATOM 579 O ASP A 77 -24.637 26.046 4.120 1.00 42.55 O ATOM 580 CB ASP A 77 -22.750 28.413 5.356 1.00 42.89 C ATOM 581 CG ASP A 77 -21.899 28.738 6.589 1.00 45.54 C ATOM 582 OD1 ASP A 77 -21.353 27.836 7.237 1.00 42.78 O ATOM 583 OD2 ASP A 77 -21.771 29.924 6.916 1.00 49.31 O ATOM 584 H ASP A 77 -20.558 27.558 4.311 1.00 0.00 H ATOM 585 N ARG A 78 -23.420 27.146 2.572 1.00 41.26 N ATOM 586 CA ARG A 78 -24.409 27.006 1.517 1.00 44.93 C ATOM 587 C ARG A 78 -24.550 25.556 1.059 1.00 43.52 C ATOM 588 O ARG A 78 -25.670 25.085 0.845 1.00 41.73 O ATOM 589 CB ARG A 78 -24.114 27.939 0.331 1.00 48.39 C ATOM 590 CG ARG A 78 -24.148 29.413 0.688 1.00 57.30 C ATOM 591 CD ARG A 78 -24.957 30.249 -0.298 1.00 67.18 C ATOM 592 NE ARG A 78 -24.481 30.192 -1.699 1.00 76.65 N ATOM 593 CZ ARG A 78 -25.209 29.812 -2.775 1.00 77.67 C ATOM 594 NH1 ARG A 78 -24.660 29.831 -4.000 1.00 73.25 N ATOM 595 NH2 ARG A 78 -26.470 29.396 -2.659 1.00 80.42 N ATOM 596 HE ARG A 78 -23.494 30.470 -1.873 1.00 0.00 H ATOM 597 HH12 ARG A 78 -25.221 29.539 -4.826 1.00 0.00 H ATOM 598 HH11 ARG A 78 -23.674 30.138 -4.123 1.00 0.00 H ATOM 599 HH22 ARG A 78 -27.003 29.111 -3.505 1.00 0.00 H ATOM 600 HH21 ARG A 78 -26.921 29.357 -1.722 1.00 0.00 H ATOM 601 H ARG A 78 -22.509 27.598 2.356 1.00 0.00 H ATOM 602 N VAL A 79 -23.425 24.852 0.944 1.00 43.01 N ATOM 603 CA VAL A 79 -23.457 23.426 0.588 1.00 40.51 C ATOM 604 C VAL A 79 -24.191 22.659 1.714 1.00 41.51 C ATOM 605 O VAL A 79 -25.038 21.816 1.433 1.00 42.50 O ATOM 606 CB VAL A 79 -22.038 22.854 0.389 1.00 39.66 C ATOM 607 CG1 VAL A 79 -22.034 21.313 0.307 1.00 39.52 C ATOM 608 CG2 VAL A 79 -21.376 23.452 -0.842 1.00 39.66 C ATOM 609 H VAL A 79 -22.510 25.318 1.109 1.00 0.00 H ATOM 610 N ALA A 80 -23.854 22.935 2.980 1.00 41.73 N ATOM 611 CA ALA A 80 -24.387 22.077 4.084 1.00 44.67 C ATOM 612 C ALA A 80 -25.846 22.326 4.287 1.00 45.48 C ATOM 613 O ALA A 80 -26.655 21.381 4.403 1.00 47.22 O ATOM 614 CB ALA A 80 -23.615 22.276 5.376 1.00 42.89 C ATOM 615 H ALA A 80 -23.228 23.738 3.194 1.00 0.00 H ATOM 616 N VAL A 81 -26.229 23.591 4.298 1.00 48.54 N ATOM 617 CA VAL A 81 -27.644 23.892 4.459 1.00 50.78 C ATOM 618 C VAL A 81 -28.463 23.296 3.317 1.00 51.10 C ATOM 619 O VAL A 81 -29.505 22.703 3.576 1.00 54.14 O ATOM 620 CB VAL A 81 -27.919 25.392 4.630 1.00 54.49 C ATOM 621 CG1 VAL A 81 -29.412 25.688 4.549 1.00 58.68 C ATOM 622 CG2 VAL A 81 -27.401 25.865 5.973 1.00 58.09 C ATOM 623 H VAL A 81 -25.533 24.357 4.194 1.00 0.00 H ATOM 624 N LYS A 82 -28.017 23.431 2.071 1.00 49.13 N ATOM 625 CA LYS A 82 -28.809 22.932 0.921 1.00 51.77 C ATOM 626 C LYS A 82 -28.872 21.382 0.897 1.00 50.02 C ATOM 627 O LYS A 82 -29.893 20.821 0.543 1.00 50.98 O ATOM 628 CB LYS A 82 -28.242 23.453 -0.414 1.00 50.38 C ATOM 629 CG LYS A 82 -29.245 23.582 -1.549 1.00 57.86 C ATOM 630 H LYS A 82 -27.101 23.893 1.901 1.00 0.00 H ATOM 631 N TYR A 83 -27.809 20.707 1.330 1.00 48.24 N ATOM 632 CA TYR A 83 -27.646 19.273 1.075 1.00 48.13 C ATOM 633 C TYR A 83 -27.446 18.332 2.239 1.00 47.07 C ATOM 634 O TYR A 83 -27.793 17.174 2.110 1.00 51.76 O ATOM 635 CB TYR A 83 -26.531 19.003 0.036 1.00 45.98 C ATOM 636 CG TYR A 83 -26.864 19.671 -1.275 1.00 47.33 C ATOM 637 CD1 TYR A 83 -28.040 19.386 -1.943 1.00 52.57 C ATOM 638 CD2 TYR A 83 -26.034 20.635 -1.802 1.00 48.40 C ATOM 639 CE1 TYR A 83 -28.369 20.040 -3.133 1.00 53.71 C ATOM 640 CE2 TYR A 83 -26.347 21.311 -2.970 1.00 49.57 C ATOM 641 CZ TYR A 83 -27.504 20.998 -3.636 1.00 53.17 C ATOM 642 OH TYR A 83 -27.754 21.678 -4.780 1.00 54.92 O ATOM 643 HH TYR A 83 -28.611 21.367 -5.167 1.00 0.00 H ATOM 644 H TYR A 83 -27.073 21.212 1.864 1.00 0.00 H ATOM 645 N PHE A 84 -26.916 18.754 3.362 1.00 47.17 N ATOM 646 CA PHE A 84 -26.435 17.742 4.303 1.00 48.58 C ATOM 647 C PHE A 84 -27.505 17.161 5.193 1.00 50.18 C ATOM 648 O PHE A 84 -27.224 16.240 5.927 1.00 55.31 O ATOM 649 CB PHE A 84 -25.227 18.238 5.116 1.00 46.64 C ATOM 650 CG PHE A 84 -23.940 18.269 4.333 1.00 44.43 C ATOM 651 CD1 PHE A 84 -23.881 17.930 2.989 1.00 43.96 C ATOM 652 CD2 PHE A 84 -22.778 18.605 4.955 1.00 46.22 C ATOM 653 CE1 PHE A 84 -22.682 17.979 2.292 1.00 43.16 C ATOM 654 CE2 PHE A 84 -21.587 18.638 4.259 1.00 43.64 C ATOM 655 CZ PHE A 84 -21.541 18.337 2.932 1.00 45.29 C ATOM 656 H PHE A 84 -26.840 19.769 3.575 1.00 0.00 H ATOM 657 N ASN A 85 -28.734 17.638 5.094 1.00 53.15 N ATOM 658 CA ASN A 85 -29.852 16.918 5.715 1.00 58.20 C ATOM 659 C ASN A 85 -30.231 15.694 4.920 1.00 57.38 C ATOM 660 O ASN A 85 -30.886 14.782 5.442 1.00 60.59 O ATOM 661 CB ASN A 85 -31.094 17.794 5.809 1.00 63.84 C ATOM 662 CG ASN A 85 -31.010 18.829 6.909 1.00 67.25 C ATOM 663 OD1 ASN A 85 -30.108 18.818 7.737 1.00 70.31 O ATOM 664 ND2 ASN A 85 -31.992 19.715 6.938 1.00 77.35 N ATOM 665 HD22 ASN A 85 -32.738 19.688 6.214 1.00 0.00 H ATOM 666 HD21 ASN A 85 -32.018 20.439 7.685 1.00 0.00 H ATOM 667 H ASN A 85 -28.908 18.523 4.576 1.00 0.00 H ATOM 668 N ASP A 86 -29.886 15.684 3.645 1.00 54.79 N ATOM 669 CA ASP A 86 -30.345 14.625 2.753 1.00 55.89 C ATOM 670 C ASP A 86 -29.253 13.739 2.142 1.00 54.01 C ATOM 671 O ASP A 86 -29.535 12.621 1.667 1.00 51.15 O ATOM 672 CB ASP A 86 -31.147 15.287 1.669 1.00 59.79 C ATOM 673 CG ASP A 86 -32.389 15.987 2.232 1.00 61.68 C ATOM 674 OD1 ASP A 86 -33.173 15.336 2.924 1.00 67.76 O ATOM 675 OD2 ASP A 86 -32.562 17.188 2.002 1.00 66.16 O ATOM 676 H ASP A 86 -29.279 16.441 3.272 1.00 0.00 H ATOM 677 N TYR A 87 -28.040 14.279 2.070 1.00 49.24 N ATOM 678 CA TYR A 87 -26.896 13.590 1.517 1.00 46.34 C ATOM 679 C TYR A 87 -25.785 13.541 2.572 1.00 45.51 C ATOM 680 O TYR A 87 -25.714 14.378 3.429 1.00 50.42 O ATOM 681 CB TYR A 87 -26.395 14.311 0.267 1.00 48.72 C ATOM 682 CG TYR A 87 -27.390 14.364 -0.843 1.00 53.68 C ATOM 683 CD1 TYR A 87 -28.277 15.423 -0.949 1.00 56.66 C ATOM 684 CD2 TYR A 87 -27.437 13.368 -1.809 1.00 57.21 C ATOM 685 CE1 TYR A 87 -29.235 15.456 -1.954 1.00 57.86 C ATOM 686 CE2 TYR A 87 -28.371 13.407 -2.834 1.00 57.90 C ATOM 687 CZ TYR A 87 -29.261 14.453 -2.896 1.00 60.30 C ATOM 688 OH TYR A 87 -30.179 14.495 -3.913 1.00 61.15 O ATOM 689 HH TYR A 87 -30.741 15.304 -3.816 1.00 0.00 H ATOM 690 H TYR A 87 -27.908 15.246 2.430 1.00 0.00 H ATOM 691 N ALA A 88 -24.946 12.524 2.523 1.00 44.65 N ATOM 692 CA ALA A 88 -23.810 12.393 3.444 1.00 41.50 C ATOM 693 C ALA A 88 -22.739 13.357 3.032 1.00 40.50 C ATOM 694 O ALA A 88 -22.562 13.628 1.851 1.00 42.69 O ATOM 695 CB ALA A 88 -23.287 10.956 3.439 1.00 41.38 C ATOM 696 H ALA A 88 -25.095 11.787 1.805 1.00 0.00 H ATOM 697 N GLY A 89 -22.011 13.888 3.999 1.00 39.35 N ATOM 698 CA GLY A 89 -20.871 14.756 3.705 1.00 38.25 C ATOM 699 C GLY A 89 -20.100 15.219 4.925 1.00 38.33 C ATOM 700 O GLY A 89 -20.608 15.186 6.068 1.00 38.61 O ATOM 701 H GLY A 89 -22.254 13.684 4.990 1.00 0.00 H ATOM 702 N ILE A 90 -18.868 15.636 4.674 1.00 32.98 N ATOM 703 CA ILE A 90 -18.040 16.290 5.666 1.00 33.74 C ATOM 704 C ILE A 90 -17.378 17.488 4.972 1.00 32.61 C ATOM 705 O ILE A 90 -16.966 17.420 3.819 1.00 31.84 O ATOM 706 CB ILE A 90 -17.040 15.295 6.312 1.00 32.47 C ATOM 707 CG1 ILE A 90 -16.380 15.911 7.524 1.00 34.46 C ATOM 708 CG2 ILE A 90 -15.920 14.911 5.339 1.00 35.98 C ATOM 709 CD1 ILE A 90 -15.647 14.958 8.423 1.00 39.82 C ATOM 710 H ILE A 90 -18.478 15.487 3.722 1.00 0.00 H ATOM 711 N ILE A 91 -17.265 18.591 5.693 1.00 30.21 N ATOM 712 CA ILE A 91 -16.550 19.756 5.235 1.00 30.61 C ATOM 713 C ILE A 91 -15.608 20.220 6.307 1.00 30.35 C ATOM 714 O ILE A 91 -15.953 20.299 7.466 1.00 30.81 O ATOM 715 CB ILE A 91 -17.518 20.884 4.861 1.00 31.26 C ATOM 716 CG1 ILE A 91 -18.525 20.426 3.799 1.00 32.40 C ATOM 717 CG2 ILE A 91 -16.762 22.135 4.483 1.00 31.88 C ATOM 718 CD1 ILE A 91 -19.524 21.479 3.432 1.00 32.56 C ATOM 719 H ILE A 91 -17.712 18.619 6.632 1.00 0.00 H ATOM 720 N TYR A 92 -14.324 20.372 5.948 1.00 28.78 N ATOM 721 CA TYR A 92 -13.335 20.842 6.874 1.00 29.04 C ATOM 722 C TYR A 92 -12.412 21.836 6.234 1.00 29.90 C ATOM 723 O TYR A 92 -12.435 22.020 5.014 1.00 30.69 O ATOM 724 CB TYR A 92 -12.543 19.663 7.444 1.00 27.64 C ATOM 725 CG TYR A 92 -11.771 18.766 6.456 1.00 27.25 C ATOM 726 CD1 TYR A 92 -12.372 17.658 5.888 1.00 30.22 C ATOM 727 CD2 TYR A 92 -10.439 19.015 6.152 1.00 29.73 C ATOM 728 CE1 TYR A 92 -11.647 16.792 5.055 1.00 30.70 C ATOM 729 CE2 TYR A 92 -9.758 18.193 5.281 1.00 32.06 C ATOM 730 CZ TYR A 92 -10.376 17.072 4.768 1.00 32.68 C ATOM 731 OH TYR A 92 -9.693 16.180 3.948 1.00 38.84 O ATOM 732 HH TYR A 92 -10.301 15.445 3.683 1.00 0.00 H ATOM 733 H TYR A 92 -14.039 20.143 4.974 1.00 0.00 H ATOM 734 N ILE A 93 -11.603 22.487 7.041 1.00 29.04 N ATOM 735 CA ILE A 93 -10.775 23.557 6.559 1.00 28.45 C ATOM 736 C ILE A 93 -9.357 23.489 7.169 1.00 31.02 C ATOM 737 O ILE A 93 -9.227 23.112 8.357 1.00 29.69 O ATOM 738 CB ILE A 93 -11.544 24.939 6.808 1.00 32.57 C ATOM 739 CG1 ILE A 93 -10.867 26.119 6.120 1.00 36.19 C ATOM 740 CG2 ILE A 93 -11.787 25.235 8.289 1.00 35.10 C ATOM 741 CD1 ILE A 93 -11.763 27.377 6.063 1.00 38.87 C ATOM 742 H ILE A 93 -11.562 22.222 8.046 1.00 0.00 H ATOM 743 N CYS A 94 -8.320 23.840 6.386 1.00 30.91 N ATOM 744 CA CYS A 94 -6.898 23.756 6.737 1.00 32.99 C ATOM 745 C CYS A 94 -6.301 25.107 6.367 1.00 34.12 C ATOM 746 O CYS A 94 -6.748 25.744 5.388 1.00 31.93 O ATOM 747 CB CYS A 94 -6.184 22.606 5.860 1.00 35.60 C ATOM 748 SG CYS A 94 -6.900 20.967 6.355 1.00 47.06 S ATOM 749 H CYS A 94 -8.549 24.206 5.440 1.00 0.00 H ATOM 750 N SER A 95 -5.195 25.494 7.006 1.00 33.22 N ATOM 751 CA SER A 95 -4.446 26.663 6.547 1.00 33.27 C ATOM 752 C SER A 95 -3.560 26.229 5.393 1.00 33.36 C ATOM 753 O SER A 95 -3.123 25.087 5.305 1.00 31.88 O ATOM 754 CB SER A 95 -3.567 27.279 7.634 1.00 37.32 C ATOM 755 OG SER A 95 -4.276 27.501 8.830 1.00 36.88 O ATOM 756 HG SER A 95 -5.029 28.120 8.656 1.00 0.00 H ATOM 757 H SER A 95 -4.864 24.961 7.835 1.00 0.00 H ATOM 758 N ALA A 96 -3.242 27.158 4.524 1.00 31.67 N ATOM 759 CA ALA A 96 -2.273 26.891 3.461 1.00 31.51 C ATOM 760 C ALA A 96 -1.646 28.223 3.079 1.00 30.13 C ATOM 761 O ALA A 96 -2.148 29.306 3.450 1.00 31.85 O ATOM 762 CB ALA A 96 -2.966 26.299 2.238 1.00 32.65 C ATOM 763 H ALA A 96 -3.684 28.097 4.591 1.00 0.00 H ATOM 764 N GLU A 97 -0.580 28.162 2.319 1.00 30.54 N ATOM 765 CA GLU A 97 -0.113 29.332 1.656 1.00 31.39 C ATOM 766 C GLU A 97 0.056 29.063 0.187 1.00 32.58 C ATOM 767 O GLU A 97 0.693 28.073 -0.194 1.00 31.92 O ATOM 768 CB GLU A 97 1.256 29.758 2.172 1.00 32.69 C ATOM 769 CG GLU A 97 1.339 30.058 3.663 1.00 38.27 C ATOM 770 CD GLU A 97 2.808 30.027 4.122 1.00 39.99 C ATOM 771 OE1 GLU A 97 3.234 28.997 4.668 1.00 41.97 O ATOM 772 OE2 GLU A 97 3.542 31.005 3.897 1.00 41.72 O ATOM 773 H GLU A 97 -0.076 27.260 2.200 1.00 0.00 H ATOM 774 N VAL A 98 -0.362 30.013 -0.647 1.00 28.84 N ATOM 775 CA VAL A 98 -0.163 29.818 -2.097 1.00 30.12 C ATOM 776 C VAL A 98 1.178 30.456 -2.515 1.00 31.49 C ATOM 777 O VAL A 98 1.489 31.640 -2.195 1.00 33.96 O ATOM 778 CB VAL A 98 -1.360 30.395 -2.874 1.00 31.58 C ATOM 779 CG1 VAL A 98 -1.149 30.287 -4.373 1.00 32.74 C ATOM 780 CG2 VAL A 98 -2.655 29.685 -2.484 1.00 31.79 C ATOM 781 H VAL A 98 -0.819 30.874 -0.285 1.00 0.00 H ATOM 782 N LEU A 99 2.015 29.696 -3.176 1.00 29.83 N ATOM 783 CA LEU A 99 3.313 30.136 -3.646 1.00 30.53 C ATOM 784 C LEU A 99 3.257 30.710 -5.072 1.00 34.38 C ATOM 785 O LEU A 99 3.940 31.655 -5.410 1.00 32.94 O ATOM 786 CB LEU A 99 4.308 29.003 -3.605 1.00 33.06 C ATOM 787 CG LEU A 99 4.524 28.448 -2.186 1.00 34.48 C ATOM 788 CD1 LEU A 99 5.573 27.372 -2.228 1.00 34.88 C ATOM 789 CD2 LEU A 99 5.011 29.562 -1.273 1.00 39.09 C ATOM 790 H LEU A 99 1.730 28.716 -3.376 1.00 0.00 H ATOM 791 N TYR A 100 2.493 30.006 -5.923 1.00 31.82 N ATOM 792 CA TYR A 100 2.321 30.386 -7.326 1.00 33.51 C ATOM 793 C TYR A 100 0.888 30.163 -7.749 1.00 35.18 C ATOM 794 O TYR A 100 0.316 29.109 -7.500 1.00 32.36 O ATOM 795 CB TYR A 100 3.261 29.636 -8.252 1.00 35.58 C ATOM 796 CG TYR A 100 4.691 30.002 -8.017 1.00 36.52 C ATOM 797 CD1 TYR A 100 5.236 31.130 -8.605 1.00 39.58 C ATOM 798 CD2 TYR A 100 5.525 29.233 -7.170 1.00 35.96 C ATOM 799 CE1 TYR A 100 6.532 31.459 -8.404 1.00 42.34 C ATOM 800 CE2 TYR A 100 6.828 29.645 -6.922 1.00 36.73 C ATOM 801 CZ TYR A 100 7.310 30.748 -7.559 1.00 41.07 C ATOM 802 OH TYR A 100 8.605 31.165 -7.464 1.00 43.92 O ATOM 803 HH TYR A 100 8.819 31.361 -6.517 1.00 0.00 H ATOM 804 H TYR A 100 2.005 29.158 -5.571 1.00 0.00 H ATOM 805 N GLY A 101 0.303 31.156 -8.442 1.00 34.03 N ATOM 806 CA GLY A 101 -1.074 30.998 -8.917 1.00 34.89 C ATOM 807 C GLY A 101 -1.589 32.305 -9.452 1.00 36.38 C ATOM 808 O GLY A 101 -1.917 33.218 -8.654 1.00 38.45 O ATOM 809 H GLY A 101 0.826 32.033 -8.640 1.00 0.00 H ATOM 810 N HIS A 102 -1.567 32.429 -10.763 1.00 36.65 N ATOM 811 CA HIS A 102 -1.779 33.731 -11.375 1.00 39.89 C ATOM 812 C HIS A 102 -3.129 34.294 -10.989 1.00 41.03 C ATOM 813 O HIS A 102 -3.228 35.489 -10.725 1.00 44.56 O ATOM 814 CB HIS A 102 -1.655 33.691 -12.871 1.00 40.76 C ATOM 815 CG HIS A 102 -0.257 33.415 -13.361 1.00 41.56 C ATOM 816 ND1 HIS A 102 0.839 34.145 -12.948 1.00 44.84 N ATOM 817 CD2 HIS A 102 0.213 32.491 -14.213 1.00 41.07 C ATOM 818 CE1 HIS A 102 1.918 33.712 -13.578 1.00 45.98 C ATOM 819 NE2 HIS A 102 1.556 32.721 -14.366 1.00 43.78 N ATOM 820 H HIS A 102 -1.398 31.595 -11.361 1.00 0.00 H ATOM 821 N THR A 103 -4.168 33.479 -10.993 1.00 39.77 N ATOM 822 CA THR A 103 -5.495 34.014 -10.662 1.00 44.06 C ATOM 823 C THR A 103 -5.656 34.225 -9.133 1.00 46.23 C ATOM 824 O THR A 103 -6.283 35.176 -8.673 1.00 44.00 O ATOM 825 CB THR A 103 -6.595 33.133 -11.238 1.00 46.28 C ATOM 826 OG1 THR A 103 -6.537 31.859 -10.613 1.00 54.26 O ATOM 827 CG2 THR A 103 -6.393 32.914 -12.687 1.00 49.07 C ATOM 828 HG1 THR A 103 -7.249 31.279 -10.982 1.00 0.00 H ATOM 829 H THR A 103 -4.048 32.473 -11.227 1.00 0.00 H ATOM 830 N PHE A 104 -5.027 33.370 -8.337 1.00 38.25 N ATOM 831 CA PHE A 104 -5.143 33.491 -6.904 1.00 38.14 C ATOM 832 C PHE A 104 -4.391 34.720 -6.368 1.00 39.82 C ATOM 833 O PHE A 104 -4.897 35.454 -5.517 1.00 41.44 O ATOM 834 CB PHE A 104 -4.610 32.215 -6.190 1.00 33.63 C ATOM 835 CG PHE A 104 -4.955 32.207 -4.706 1.00 33.22 C ATOM 836 CD1 PHE A 104 -6.177 31.698 -4.289 1.00 35.21 C ATOM 837 CD2 PHE A 104 -4.098 32.744 -3.769 1.00 31.74 C ATOM 838 CE1 PHE A 104 -6.543 31.705 -2.942 1.00 31.64 C ATOM 839 CE2 PHE A 104 -4.455 32.757 -2.428 1.00 32.76 C ATOM 840 CZ PHE A 104 -5.659 32.236 -2.012 1.00 31.92 C ATOM 841 H PHE A 104 -4.448 32.610 -8.748 1.00 0.00 H ATOM 842 N CYS A 105 -3.182 34.955 -6.880 1.00 38.04 N ATOM 843 CA CYS A 105 -2.304 35.968 -6.357 1.00 41.23 C ATOM 844 C CYS A 105 -2.340 37.271 -7.141 1.00 45.83 C ATOM 845 O CYS A 105 -1.885 38.293 -6.636 1.00 44.49 O ATOM 846 CB CYS A 105 -0.874 35.436 -6.325 1.00 43.90 C ATOM 847 SG CYS A 105 -0.721 34.064 -5.098 1.00 42.54 S ATOM 848 H CYS A 105 -2.862 34.384 -7.688 1.00 0.00 H ATOM 849 N GLY A 106 -2.858 37.216 -8.365 1.00 44.95 N ATOM 850 CA GLY A 106 -2.811 38.337 -9.270 1.00 46.44 C ATOM 851 C GLY A 106 -1.490 38.398 -10.005 1.00 51.01 C ATOM 852 O GLY A 106 -0.589 37.599 -9.766 1.00 47.97 O ATOM 853 H GLY A 106 -3.312 36.335 -8.680 1.00 0.00 H ATOM 854 N PRO A 107 -1.334 39.396 -10.893 1.00 55.97 N ATOM 855 CA PRO A 107 -0.169 39.458 -11.779 1.00 59.51 C ATOM 856 C PRO A 107 1.183 39.833 -11.100 1.00 57.17 C ATOM 857 O PRO A 107 2.238 39.498 -11.633 1.00 62.72 O ATOM 858 CB PRO A 107 -0.591 40.522 -12.817 1.00 63.36 C ATOM 859 CG PRO A 107 -1.519 41.421 -12.071 1.00 62.48 C ATOM 860 CD PRO A 107 -2.262 40.523 -11.100 1.00 60.11 C ATOM 861 N GLU A 108 1.131 40.530 -9.973 1.00 57.23 N ATOM 862 CA GLU A 108 2.287 40.788 -9.100 1.00 59.54 C ATOM 863 C GLU A 108 2.881 39.522 -8.425 1.00 56.81 C ATOM 864 O GLU A 108 3.980 39.554 -7.852 1.00 56.73 O ATOM 865 CB GLU A 108 1.869 41.730 -7.965 1.00 60.41 C ATOM 866 H GLU A 108 0.211 40.921 -9.687 1.00 0.00 H ATOM 867 N GLY A 109 2.139 38.429 -8.452 1.00 54.73 N ATOM 868 CA GLY A 109 2.591 37.206 -7.812 1.00 48.40 C ATOM 869 C GLY A 109 2.208 37.189 -6.354 1.00 46.96 C ATOM 870 O GLY A 109 1.517 38.105 -5.821 1.00 44.72 O ATOM 871 H GLY A 109 1.220 38.445 -8.938 1.00 0.00 H ATOM 872 N CYS A 110 2.653 36.108 -5.710 1.00 43.90 N ATOM 873 CA CYS A 110 2.224 35.732 -4.366 1.00 43.91 C ATOM 874 C CYS A 110 3.205 36.267 -3.298 1.00 48.60 C ATOM 875 O CYS A 110 3.062 35.910 -2.137 1.00 45.31 O ATOM 876 CB CYS A 110 2.146 34.197 -4.216 1.00 42.09 C ATOM 877 SG CYS A 110 1.082 33.311 -5.429 1.00 43.09 S ATOM 878 H CYS A 110 3.344 35.499 -6.193 1.00 0.00 H ATOM 879 N SER A 111 4.184 37.081 -3.708 1.00 56.33 N ATOM 880 CA SER A 111 5.310 37.541 -2.840 1.00 64.39 C ATOM 881 C SER A 111 6.149 36.362 -2.358 1.00 66.31 C ATOM 882 O SER A 111 7.325 36.253 -2.683 1.00 76.47 O ATOM 883 CB SER A 111 4.809 38.385 -1.659 1.00 66.87 C ATOM 884 OG SER A 111 4.415 39.659 -2.139 1.00 65.33 O ATOM 885 HG SER A 111 4.091 40.209 -1.383 1.00 0.00 H ATOM 886 H SER A 111 4.160 37.415 -4.693 1.00 0.00 H TER 887 SER A 111 ATOM 888 N ALA B 2 -16.785 25.527 14.640 1.00 47.07 N ATOM 889 CA ALA B 2 -15.844 24.541 14.073 1.00 43.88 C ATOM 890 C ALA B 2 -15.344 23.649 15.210 1.00 43.82 C ATOM 891 O ALA B 2 -15.234 24.076 16.361 1.00 45.55 O ATOM 892 CB ALA B 2 -14.689 25.254 13.391 1.00 45.20 C ATOM 893 HN3 ALA B 2 -16.295 26.100 15.356 1.00 0.00 H ATOM 894 HN2 ALA B 2 -17.584 25.028 15.081 1.00 0.00 H ATOM 895 HN1 ALA B 2 -17.137 26.145 13.881 1.00 0.00 H ATOM 896 N LYS B 3 -15.118 22.411 14.886 1.00 38.47 N ATOM 897 CA LYS B 3 -14.517 21.419 15.760 1.00 42.42 C ATOM 898 C LYS B 3 -13.090 21.103 15.377 1.00 38.20 C ATOM 899 O LYS B 3 -12.846 20.613 14.283 1.00 36.68 O ATOM 900 CB LYS B 3 -15.369 20.168 15.683 1.00 44.86 C ATOM 901 CG LYS B 3 -15.088 19.128 16.731 1.00 52.44 C ATOM 902 CD LYS B 3 -16.181 18.066 16.672 1.00 55.44 C ATOM 903 CE LYS B 3 -15.674 16.695 17.122 1.00 59.94 C ATOM 904 NZ LYS B 3 -15.235 16.629 18.519 1.00 61.02 N ATOM 905 HZ1 LYS B 3 -14.455 17.301 18.668 1.00 0.00 H ATOM 906 HZ2 LYS B 3 -16.030 16.874 19.143 1.00 0.00 H ATOM 907 HZ3 LYS B 3 -14.909 15.665 18.734 1.00 0.00 H ATOM 908 H LYS B 3 -15.388 22.108 13.929 1.00 0.00 H ATOM 909 N PRO B 4 -12.134 21.269 16.306 1.00 38.67 N ATOM 910 CA PRO B 4 -10.736 20.848 16.100 1.00 38.10 C ATOM 911 C PRO B 4 -10.617 19.403 15.666 1.00 36.77 C ATOM 912 O PRO B 4 -11.355 18.526 16.186 1.00 39.52 O ATOM 913 CB PRO B 4 -10.110 21.060 17.505 1.00 42.84 C ATOM 914 CG PRO B 4 -10.944 22.138 18.071 1.00 44.63 C ATOM 915 CD PRO B 4 -12.333 21.794 17.667 1.00 44.47 C ATOM 916 N ALA B 5 -9.733 19.125 14.696 1.00 32.34 N ATOM 917 CA ALA B 5 -9.528 17.799 14.213 1.00 31.90 C ATOM 918 C ALA B 5 -8.084 17.572 13.801 1.00 30.78 C ATOM 919 O ALA B 5 -7.343 18.523 13.637 1.00 35.32 O ATOM 920 CB ALA B 5 -10.429 17.525 13.036 1.00 32.79 C ATOM 921 H ALA B 5 -9.179 19.902 14.283 1.00 0.00 H ATOM 922 N ASN B 6 -7.658 16.333 13.790 1.00 32.33 N ATOM 923 CA ASN B 6 -6.373 15.987 13.227 1.00 32.57 C ATOM 924 C ASN B 6 -6.749 15.289 11.912 1.00 31.05 C ATOM 925 O ASN B 6 -7.609 14.433 11.929 1.00 30.71 O ATOM 926 CB ASN B 6 -5.667 14.999 14.135 1.00 34.73 C ATOM 927 CG ASN B 6 -5.170 15.652 15.445 1.00 42.90 C ATOM 928 OD1 ASN B 6 -4.040 16.114 15.512 1.00 48.77 O ATOM 929 ND2 ASN B 6 -6.032 15.753 16.415 1.00 44.72 N ATOM 930 HD22 ASN B 6 -6.982 15.343 16.311 1.00 0.00 H ATOM 931 HD21 ASN B 6 -5.771 16.243 17.294 1.00 0.00 H ATOM 932 H ASN B 6 -8.256 15.584 14.194 1.00 0.00 H ATOM 933 N LYS B 7 -6.022 15.567 10.844 1.00 28.38 N ATOM 934 CA LYS B 7 -6.258 14.871 9.644 1.00 26.25 C ATOM 935 C LYS B 7 -5.040 13.954 9.441 1.00 26.35 C ATOM 936 O LYS B 7 -3.905 14.471 9.280 1.00 28.89 O ATOM 937 CB LYS B 7 -6.292 15.848 8.486 1.00 27.52 C ATOM 938 CG LYS B 7 -6.380 15.117 7.150 1.00 32.17 C ATOM 939 CD LYS B 7 -6.342 16.177 6.046 1.00 38.28 C ATOM 940 CE LYS B 7 -6.592 15.557 4.700 1.00 51.63 C ATOM 941 NZ LYS B 7 -6.643 16.585 3.580 1.00 60.00 N ATOM 942 HZ1 LYS B 7 -7.410 17.262 3.767 1.00 0.00 H ATOM 943 HZ2 LYS B 7 -5.736 17.091 3.534 1.00 0.00 H ATOM 944 HZ3 LYS B 7 -6.818 16.102 2.676 1.00 0.00 H ATOM 945 H LYS B 7 -5.281 16.295 10.890 1.00 0.00 H ATOM 946 N LEU B 8 -5.252 12.656 9.552 1.00 26.66 N ATOM 947 CA LEU B 8 -4.211 11.686 9.348 1.00 24.60 C ATOM 948 C LEU B 8 -4.293 11.216 7.888 1.00 25.81 C ATOM 949 O LEU B 8 -5.379 10.831 7.411 1.00 26.19 O ATOM 950 CB LEU B 8 -4.492 10.488 10.270 1.00 26.11 C ATOM 951 CG LEU B 8 -3.469 9.365 10.281 1.00 27.53 C ATOM 952 CD1 LEU B 8 -2.195 9.888 10.861 1.00 28.24 C ATOM 953 CD2 LEU B 8 -4.050 8.163 11.025 1.00 29.52 C ATOM 954 H LEU B 8 -6.207 12.323 9.796 1.00 0.00 H ATOM 955 N VAL B 9 -3.146 11.160 7.271 1.00 23.15 N ATOM 956 CA VAL B 9 -2.944 10.686 5.942 1.00 22.78 C ATOM 957 C VAL B 9 -2.021 9.493 5.956 1.00 24.53 C ATOM 958 O VAL B 9 -0.917 9.581 6.497 1.00 24.13 O ATOM 959 CB VAL B 9 -2.394 11.824 5.056 1.00 24.12 C ATOM 960 CG1 VAL B 9 -2.186 11.358 3.615 1.00 28.17 C ATOM 961 CG2 VAL B 9 -3.328 13.034 5.151 1.00 30.57 C ATOM 962 H VAL B 9 -2.308 11.489 7.792 1.00 0.00 H ATOM 963 N ILE B 10 -2.455 8.443 5.253 1.00 22.34 N ATOM 964 CA ILE B 10 -1.663 7.217 5.033 1.00 23.99 C ATOM 965 C ILE B 10 -1.571 7.014 3.547 1.00 26.19 C ATOM 966 O ILE B 10 -2.624 6.848 2.930 1.00 25.74 O ATOM 967 CB ILE B 10 -2.338 6.014 5.684 1.00 25.51 C ATOM 968 CG1 ILE B 10 -2.618 6.265 7.186 1.00 27.19 C ATOM 969 CG2 ILE B 10 -1.528 4.790 5.508 1.00 25.38 C ATOM 970 CD1 ILE B 10 -3.482 5.170 7.827 1.00 29.53 C ATOM 971 H ILE B 10 -3.407 8.492 4.836 1.00 0.00 H ATOM 972 N VAL B 11 -0.352 6.955 2.981 1.00 26.47 N ATOM 973 CA VAL B 11 -0.151 6.623 1.609 1.00 26.21 C ATOM 974 C VAL B 11 0.666 5.314 1.603 1.00 27.60 C ATOM 975 O VAL B 11 1.743 5.255 2.220 1.00 28.15 O ATOM 976 CB VAL B 11 0.584 7.705 0.825 1.00 26.86 C ATOM 977 CG1 VAL B 11 0.673 7.303 -0.611 1.00 30.81 C ATOM 978 CG2 VAL B 11 -0.131 8.997 0.971 1.00 26.99 C ATOM 979 H VAL B 11 0.480 7.161 3.570 1.00 0.00 H ATOM 980 N THR B 12 0.108 4.276 1.013 1.00 26.33 N ATOM 981 CA THR B 12 0.759 2.956 1.093 1.00 28.26 C ATOM 982 C THR B 12 0.325 2.093 -0.024 1.00 33.00 C ATOM 983 O THR B 12 -0.356 2.546 -0.967 1.00 30.81 O ATOM 984 CB THR B 12 0.484 2.283 2.459 1.00 29.68 C ATOM 985 OG1 THR B 12 1.357 1.181 2.633 1.00 31.86 O ATOM 986 CG2 THR B 12 -0.895 1.894 2.575 1.00 30.33 C ATOM 987 HG1 THR B 12 2.295 1.497 2.605 1.00 0.00 H ATOM 988 H THR B 12 -0.786 4.388 0.494 1.00 0.00 H ATOM 989 N GLU B 13 0.708 0.848 0.052 1.00 34.92 N ATOM 990 CA GLU B 13 0.412 -0.093 -1.060 1.00 36.46 C ATOM 991 C GLU B 13 -1.011 -0.512 -1.037 1.00 37.26 C ATOM 992 O GLU B 13 -1.668 -0.789 -0.028 1.00 34.49 O ATOM 993 CB GLU B 13 1.418 -1.257 -1.064 1.00 38.45 C ATOM 994 CG GLU B 13 2.868 -0.829 -1.093 1.00 40.82 C ATOM 995 CD GLU B 13 3.843 -2.012 -1.174 1.00 44.19 C ATOM 996 OE1 GLU B 13 3.496 -2.969 -1.857 1.00 45.58 O ATOM 997 OE2 GLU B 13 4.991 -1.936 -0.653 1.00 42.47 O ATOM 998 H GLU B 13 1.221 0.513 0.892 1.00 0.00 H ATOM 999 N LYS B 14 -1.603 -0.615 -2.239 1.00 37.32 N ATOM 1000 CA LYS B 14 -3.000 -0.981 -2.289 1.00 34.41 C ATOM 1001 C LYS B 14 -3.438 -2.252 -1.696 1.00 35.03 C ATOM 1002 O LYS B 14 -4.571 -2.391 -1.253 1.00 36.96 O ATOM 1003 CB LYS B 14 -3.408 -0.970 -3.806 1.00 42.24 C ATOM 1004 CG LYS B 14 -4.865 -0.948 -3.994 1.00 43.05 C ATOM 1005 CD LYS B 14 -5.132 -0.254 -5.333 1.00 48.00 C ATOM 1006 CE LYS B 14 -6.559 -0.455 -5.656 1.00 46.46 C ATOM 1007 NZ LYS B 14 -6.845 0.132 -6.968 1.00 46.68 N ATOM 1008 HZ1 LYS B 14 -6.632 1.150 -6.945 1.00 0.00 H ATOM 1009 HZ2 LYS B 14 -6.255 -0.330 -7.689 1.00 0.00 H ATOM 1010 HZ3 LYS B 14 -7.850 -0.008 -7.198 1.00 0.00 H ATOM 1011 H LYS B 14 -1.068 -0.436 -3.113 1.00 0.00 H ATOM 1012 N ILE B 15 -2.574 -3.265 -1.697 1.00 39.09 N ATOM 1013 CA ILE B 15 -2.870 -4.525 -1.088 1.00 42.43 C ATOM 1014 C ILE B 15 -3.245 -4.423 0.389 1.00 37.85 C ATOM 1015 O ILE B 15 -3.950 -5.284 0.901 1.00 40.28 O ATOM 1016 CB ILE B 15 -1.655 -5.491 -1.248 1.00 45.73 C ATOM 1017 CG1 ILE B 15 -2.058 -6.906 -0.851 1.00 50.78 C ATOM 1018 CG2 ILE B 15 -0.453 -4.957 -0.451 1.00 45.58 C ATOM 1019 CD1 ILE B 15 -1.720 -7.959 -1.875 1.00 58.18 C ATOM 1020 H ILE B 15 -1.650 -3.135 -2.157 1.00 0.00 H ATOM 1021 N LEU B 16 -2.908 -3.289 1.020 1.00 37.65 N ATOM 1022 CA LEU B 16 -3.196 -3.098 2.443 1.00 36.38 C ATOM 1023 C LEU B 16 -4.541 -2.438 2.680 1.00 36.82 C ATOM 1024 O LEU B 16 -4.951 -2.259 3.822 1.00 34.34 O ATOM 1025 CB LEU B 16 -2.115 -2.274 3.064 1.00 34.49 C ATOM 1026 CG LEU B 16 -0.774 -2.935 3.126 1.00 33.87 C ATOM 1027 CD1 LEU B 16 0.146 -1.999 3.796 1.00 33.95 C ATOM 1028 CD2 LEU B 16 -0.859 -4.243 3.864 1.00 35.25 C ATOM 1029 H LEU B 16 -2.433 -2.531 0.489 1.00 0.00 H ATOM 1030 N LEU B 17 -5.289 -2.142 1.582 1.00 35.10 N ATOM 1031 CA LEU B 17 -6.593 -1.482 1.739 1.00 34.92 C ATOM 1032 C LEU B 17 -7.504 -2.038 2.803 1.00 31.91 C ATOM 1033 O LEU B 17 -7.928 -1.295 3.673 1.00 35.45 O ATOM 1034 CB LEU B 17 -7.391 -1.454 0.387 1.00 39.17 C ATOM 1035 CG LEU B 17 -8.828 -0.933 0.541 1.00 40.40 C ATOM 1036 CD1 LEU B 17 -8.740 0.541 0.478 1.00 41.47 C ATOM 1037 CD2 LEU B 17 -9.750 -1.480 -0.587 1.00 49.21 C ATOM 1038 H LEU B 17 -4.938 -2.383 0.633 1.00 0.00 H ATOM 1039 N LYS B 18 -7.837 -3.316 2.777 1.00 34.19 N ATOM 1040 CA LYS B 18 -8.816 -3.859 3.696 1.00 35.58 C ATOM 1041 C LYS B 18 -8.233 -3.916 5.114 1.00 32.50 C ATOM 1042 O LYS B 18 -8.946 -3.743 6.086 1.00 36.44 O ATOM 1043 CB LYS B 18 -9.342 -5.248 3.218 1.00 42.23 C ATOM 1044 CG LYS B 18 -9.734 -5.199 1.732 1.00 44.82 C ATOM 1045 H LYS B 18 -7.387 -3.945 2.082 1.00 0.00 H ATOM 1046 N LYS B 19 -6.965 -4.260 5.198 1.00 35.23 N ATOM 1047 CA LYS B 19 -6.364 -4.382 6.573 1.00 36.24 C ATOM 1048 C LYS B 19 -6.325 -2.988 7.238 1.00 31.84 C ATOM 1049 O LYS B 19 -6.628 -2.904 8.424 1.00 32.67 O ATOM 1050 CB LYS B 19 -5.026 -5.024 6.508 1.00 38.41 C ATOM 1051 CG LYS B 19 -5.038 -6.529 6.250 1.00 42.59 C ATOM 1052 CD LYS B 19 -3.652 -6.882 5.782 1.00 51.11 C ATOM 1053 CE LYS B 19 -3.349 -8.368 5.828 1.00 56.71 C ATOM 1054 NZ LYS B 19 -4.106 -8.970 4.728 1.00 60.15 N ATOM 1055 HZ1 LYS B 19 -5.121 -8.789 4.867 1.00 0.00 H ATOM 1056 HZ2 LYS B 19 -3.798 -8.551 3.827 1.00 0.00 H ATOM 1057 HZ3 LYS B 19 -3.935 -9.996 4.712 1.00 0.00 H ATOM 1058 H LYS B 19 -6.399 -4.441 4.345 1.00 0.00 H ATOM 1059 N ILE B 20 -6.031 -1.925 6.484 1.00 30.06 N ATOM 1060 CA ILE B 20 -5.957 -0.558 7.064 1.00 28.68 C ATOM 1061 C ILE B 20 -7.364 -0.066 7.334 1.00 32.08 C ATOM 1062 O ILE B 20 -7.650 0.513 8.372 1.00 28.50 O ATOM 1063 CB ILE B 20 -5.151 0.384 6.201 1.00 28.74 C ATOM 1064 CG1 ILE B 20 -3.715 -0.142 6.152 1.00 32.41 C ATOM 1065 CG2 ILE B 20 -5.272 1.843 6.672 1.00 26.64 C ATOM 1066 CD1 ILE B 20 -2.823 0.622 5.236 1.00 31.36 C ATOM 1067 H ILE B 20 -5.850 -2.057 5.468 1.00 0.00 H ATOM 1068 N ALA B 21 -8.315 -0.344 6.425 1.00 31.17 N ATOM 1069 CA ALA B 21 -9.715 -0.019 6.739 1.00 31.22 C ATOM 1070 C ALA B 21 -10.239 -0.596 8.054 1.00 32.63 C ATOM 1071 O ALA B 21 -10.906 0.105 8.807 1.00 33.48 O ATOM 1072 CB ALA B 21 -10.601 -0.449 5.561 1.00 36.15 C ATOM 1073 H ALA B 21 -8.065 -0.781 5.515 1.00 0.00 H ATOM 1074 N LYS B 22 -9.913 -1.867 8.327 1.00 34.31 N ATOM 1075 CA LYS B 22 -10.332 -2.499 9.573 1.00 36.90 C ATOM 1076 C LYS B 22 -9.687 -1.831 10.775 1.00 35.54 C ATOM 1077 O LYS B 22 -10.364 -1.568 11.776 1.00 33.67 O ATOM 1078 CB LYS B 22 -10.048 -3.990 9.564 1.00 40.73 C ATOM 1079 CG LYS B 22 -10.860 -4.755 10.593 1.00 45.03 C ATOM 1080 CD LYS B 22 -10.874 -6.246 10.291 1.00 51.41 C ATOM 1081 CE LYS B 22 -9.842 -7.016 11.115 1.00 52.34 C ATOM 1082 NZ LYS B 22 -10.309 -7.254 12.497 1.00 51.84 N ATOM 1083 HZ1 LYS B 22 -10.485 -6.342 12.964 1.00 0.00 H ATOM 1084 HZ2 LYS B 22 -11.188 -7.809 12.474 1.00 0.00 H ATOM 1085 HZ3 LYS B 22 -9.581 -7.779 13.022 1.00 0.00 H ATOM 1086 H LYS B 22 -9.353 -2.411 7.640 1.00 0.00 H ATOM 1087 N ILE B 23 -8.392 -1.507 10.684 1.00 31.54 N ATOM 1088 CA ILE B 23 -7.698 -0.734 11.760 1.00 30.59 C ATOM 1089 C ILE B 23 -8.404 0.578 12.021 1.00 30.17 C ATOM 1090 O ILE B 23 -8.673 0.987 13.175 1.00 30.90 O ATOM 1091 CB ILE B 23 -6.221 -0.526 11.406 1.00 28.04 C ATOM 1092 CG1 ILE B 23 -5.472 -1.887 11.521 1.00 31.26 C ATOM 1093 CG2 ILE B 23 -5.615 0.538 12.332 1.00 28.64 C ATOM 1094 CD1 ILE B 23 -4.050 -1.963 10.962 1.00 30.73 C ATOM 1095 H ILE B 23 -7.854 -1.800 9.844 1.00 0.00 H ATOM 1096 N ILE B 24 -8.742 1.286 10.934 1.00 30.26 N ATOM 1097 CA ILE B 24 -9.446 2.506 11.099 1.00 29.67 C ATOM 1098 C ILE B 24 -10.810 2.337 11.847 1.00 30.69 C ATOM 1099 O ILE B 24 -11.105 3.107 12.775 1.00 34.10 O ATOM 1100 CB ILE B 24 -9.645 3.234 9.733 1.00 27.27 C ATOM 1101 CG1 ILE B 24 -8.312 3.661 9.174 1.00 27.48 C ATOM 1102 CG2 ILE B 24 -10.520 4.484 9.934 1.00 28.23 C ATOM 1103 CD1 ILE B 24 -8.375 4.044 7.709 1.00 27.59 C ATOM 1104 H ILE B 24 -8.492 0.946 9.984 1.00 0.00 H ATOM 1105 N ASP B 25 -11.597 1.401 11.389 1.00 35.19 N ATOM 1106 CA ASP B 25 -12.869 1.029 12.022 1.00 42.00 C ATOM 1107 C ASP B 25 -12.647 0.674 13.481 1.00 44.94 C ATOM 1108 O ASP B 25 -13.288 1.238 14.346 1.00 42.38 O ATOM 1109 CB ASP B 25 -13.472 -0.123 11.265 1.00 42.77 C ATOM 1110 CG ASP B 25 -14.024 0.341 9.872 1.00 50.01 C ATOM 1111 OD1 ASP B 25 -14.150 1.596 9.613 1.00 50.02 O ATOM 1112 OD2 ASP B 25 -14.220 -0.539 9.019 1.00 54.83 O ATOM 1113 H ASP B 25 -11.307 0.892 10.530 1.00 0.00 H ATOM 1114 N GLU B 26 -11.646 -0.159 13.755 1.00 38.30 N ATOM 1115 CA GLU B 26 -11.336 -0.526 15.138 1.00 40.23 C ATOM 1116 C GLU B 26 -10.901 0.617 16.053 1.00 38.37 C ATOM 1117 O GLU B 26 -11.069 0.494 17.312 1.00 40.11 O ATOM 1118 CB GLU B 26 -10.331 -1.687 15.219 1.00 39.89 C ATOM 1119 CG GLU B 26 -10.923 -2.966 14.687 1.00 43.30 C ATOM 1120 CD GLU B 26 -9.883 -4.073 14.506 1.00 49.48 C ATOM 1121 OE1 GLU B 26 -8.653 -3.808 14.385 1.00 51.46 O ATOM 1122 OE2 GLU B 26 -10.318 -5.221 14.419 1.00 56.65 O ATOM 1123 H GLU B 26 -11.078 -0.554 12.978 1.00 0.00 H ATOM 1124 N SER B 27 -10.429 1.725 15.479 1.00 35.93 N ATOM 1125 CA SER B 27 -9.868 2.820 16.269 1.00 37.02 C ATOM 1126 C SER B 27 -10.925 3.664 16.958 1.00 39.06 C ATOM 1127 O SER B 27 -10.617 4.473 17.849 1.00 40.41 O ATOM 1128 CB SER B 27 -9.031 3.727 15.397 1.00 37.12 C ATOM 1129 OG SER B 27 -9.849 4.494 14.530 1.00 36.90 O ATOM 1130 HG SER B 27 -10.372 3.887 13.948 1.00 0.00 H ATOM 1131 H SER B 27 -10.461 1.812 14.443 1.00 0.00 H ATOM 1132 N GLY B 28 -12.169 3.536 16.501 1.00 37.08 N ATOM 1133 CA GLY B 28 -13.217 4.505 16.829 1.00 40.90 C ATOM 1134 C GLY B 28 -13.376 5.733 15.951 1.00 36.51 C ATOM 1135 O GLY B 28 -14.309 6.497 16.140 1.00 36.56 O ATOM 1136 H GLY B 28 -12.403 2.725 15.894 1.00 0.00 H ATOM 1137 N ALA B 29 -12.523 5.911 14.951 1.00 34.72 N ATOM 1138 CA ALA B 29 -12.696 6.946 13.944 1.00 33.50 C ATOM 1139 C ALA B 29 -14.061 6.786 13.294 1.00 34.12 C ATOM 1140 O ALA B 29 -14.542 5.671 13.095 1.00 33.52 O ATOM 1141 CB ALA B 29 -11.607 6.862 12.886 1.00 32.68 C ATOM 1142 H ALA B 29 -11.696 5.284 14.884 1.00 0.00 H ATOM 1143 N LYS B 30 -14.655 7.915 12.943 1.00 33.59 N ATOM 1144 CA LYS B 30 -16.055 7.969 12.550 1.00 39.25 C ATOM 1145 C LYS B 30 -16.172 7.684 11.098 1.00 37.64 C ATOM 1146 O LYS B 30 -17.242 7.408 10.618 1.00 40.66 O ATOM 1147 CB LYS B 30 -16.623 9.366 12.778 1.00 42.86 C ATOM 1148 CG LYS B 30 -16.628 9.805 14.229 1.00 46.80 C ATOM 1149 CD LYS B 30 -17.247 8.787 15.127 1.00 51.02 C ATOM 1150 CE LYS B 30 -17.548 9.431 16.481 1.00 57.75 C ATOM 1151 NZ LYS B 30 -18.214 8.414 17.313 1.00 65.99 N ATOM 1152 HZ1 LYS B 30 -19.094 8.111 16.849 1.00 0.00 H ATOM 1153 HZ2 LYS B 30 -17.583 7.596 17.430 1.00 0.00 H ATOM 1154 HZ3 LYS B 30 -18.434 8.820 18.245 1.00 0.00 H ATOM 1155 H LYS B 30 -14.101 8.795 12.948 1.00 0.00 H ATOM 1156 N GLY B 31 -15.078 7.795 10.372 1.00 36.56 N ATOM 1157 CA GLY B 31 -15.145 7.671 8.888 1.00 36.77 C ATOM 1158 C GLY B 31 -13.775 7.738 8.299 1.00 32.46 C ATOM 1159 O GLY B 31 -12.790 7.956 8.987 1.00 31.01 O ATOM 1160 H GLY B 31 -14.164 7.970 10.836 1.00 0.00 H ATOM 1161 N TYR B 32 -13.695 7.604 6.997 1.00 29.91 N ATOM 1162 CA TYR B 32 -12.432 7.829 6.292 1.00 28.49 C ATOM 1163 C TYR B 32 -12.721 8.012 4.809 1.00 26.63 C ATOM 1164 O TYR B 32 -13.815 7.557 4.291 1.00 29.46 O ATOM 1165 CB TYR B 32 -11.430 6.699 6.478 1.00 26.38 C ATOM 1166 CG TYR B 32 -11.881 5.302 6.001 1.00 28.90 C ATOM 1167 CD1 TYR B 32 -11.738 4.921 4.661 1.00 30.02 C ATOM 1168 CD2 TYR B 32 -12.447 4.414 6.880 1.00 30.96 C ATOM 1169 CE1 TYR B 32 -12.145 3.679 4.257 1.00 30.83 C ATOM 1170 CE2 TYR B 32 -12.858 3.166 6.460 1.00 36.28 C ATOM 1171 CZ TYR B 32 -12.735 2.829 5.135 1.00 36.28 C ATOM 1172 OH TYR B 32 -13.196 1.613 4.687 1.00 39.95 O ATOM 1173 HH TYR B 32 -14.168 1.545 4.862 1.00 0.00 H ATOM 1174 H TYR B 32 -14.542 7.334 6.457 1.00 0.00 H ATOM 1175 N THR B 33 -11.764 8.638 4.161 1.00 26.09 N ATOM 1176 CA THR B 33 -11.765 8.800 2.716 1.00 28.05 C ATOM 1177 C THR B 33 -10.567 8.046 2.152 1.00 28.78 C ATOM 1178 O THR B 33 -9.486 8.010 2.742 1.00 27.39 O ATOM 1179 CB THR B 33 -11.754 10.317 2.358 1.00 28.01 C ATOM 1180 OG1 THR B 33 -12.971 10.859 2.921 1.00 33.68 O ATOM 1181 CG2 THR B 33 -11.875 10.487 0.907 1.00 31.82 C ATOM 1182 HG1 THR B 33 -13.021 11.828 2.725 1.00 0.00 H ATOM 1183 H THR B 33 -10.972 9.035 4.705 1.00 0.00 H ATOM 1184 N VAL B 34 -10.753 7.400 1.017 1.00 27.20 N ATOM 1185 CA VAL B 34 -9.682 6.625 0.408 1.00 28.02 C ATOM 1186 C VAL B 34 -9.647 7.018 -1.084 1.00 31.86 C ATOM 1187 O VAL B 34 -10.659 7.366 -1.689 1.00 32.39 O ATOM 1188 CB VAL B 34 -9.793 5.085 0.702 1.00 30.15 C ATOM 1189 CG1 VAL B 34 -11.025 4.428 0.065 1.00 34.76 C ATOM 1190 CG2 VAL B 34 -8.518 4.416 0.294 1.00 33.62 C ATOM 1191 H VAL B 34 -11.681 7.445 0.549 1.00 0.00 H ATOM 1192 N MET B 35 -8.455 6.980 -1.675 1.00 28.60 N ATOM 1193 CA MET B 35 -8.323 7.282 -3.101 1.00 29.24 C ATOM 1194 C MET B 35 -7.175 6.568 -3.730 1.00 30.12 C ATOM 1195 O MET B 35 -6.192 6.245 -3.073 1.00 26.72 O ATOM 1196 CB MET B 35 -8.222 8.773 -3.268 1.00 33.72 C ATOM 1197 CG MET B 35 -6.993 9.449 -2.787 1.00 37.56 C ATOM 1198 SD MET B 35 -7.374 11.211 -2.397 1.00 50.28 S ATOM 1199 CE MET B 35 -8.123 11.027 -0.770 1.00 45.40 C ATOM 1200 H MET B 35 -7.611 6.734 -1.119 1.00 0.00 H ATOM 1201 N ASN B 36 -7.317 6.263 -5.013 1.00 27.81 N ATOM 1202 CA ASN B 36 -6.249 5.620 -5.753 1.00 30.95 C ATOM 1203 C ASN B 36 -5.243 6.730 -6.106 1.00 32.28 C ATOM 1204 O ASN B 36 -5.679 7.763 -6.576 1.00 33.74 O ATOM 1205 CB ASN B 36 -6.781 5.021 -7.039 1.00 34.85 C ATOM 1206 CG ASN B 36 -7.508 3.764 -6.800 1.00 39.51 C ATOM 1207 OD1 ASN B 36 -6.984 2.856 -6.168 1.00 41.61 O ATOM 1208 ND2 ASN B 36 -8.722 3.691 -7.296 1.00 43.18 N ATOM 1209 HD22 ASN B 36 -9.117 4.495 -7.825 1.00 0.00 H ATOM 1210 HD21 ASN B 36 -9.289 2.830 -7.159 1.00 0.00 H ATOM 1211 H ASN B 36 -8.210 6.489 -5.496 1.00 0.00 H ATOM 1212 N THR B 37 -3.928 6.498 -5.948 1.00 28.65 N ATOM 1213 CA THR B 37 -2.936 7.499 -6.291 1.00 27.84 C ATOM 1214 C THR B 37 -1.730 6.772 -6.880 1.00 31.37 C ATOM 1215 O THR B 37 -1.729 5.540 -6.999 1.00 33.55 O ATOM 1216 CB THR B 37 -2.496 8.318 -5.007 1.00 32.24 C ATOM 1217 OG1 THR B 37 -2.065 7.363 -4.046 1.00 35.18 O ATOM 1218 CG2 THR B 37 -3.622 9.044 -4.386 1.00 32.83 C ATOM 1219 HG1 THR B 37 -1.779 7.832 -3.222 1.00 0.00 H ATOM 1220 H THR B 37 -3.615 5.580 -5.571 1.00 0.00 H ATOM 1221 N GLY B 38 -0.863 7.530 -7.527 1.00 31.49 N ATOM 1222 CA GLY B 38 0.379 7.043 -8.038 1.00 33.48 C ATOM 1223 C GLY B 38 1.460 7.606 -7.126 1.00 32.64 C ATOM 1224 O GLY B 38 1.267 8.647 -6.462 1.00 30.52 O ATOM 1225 H GLY B 38 -1.097 8.533 -7.672 1.00 0.00 H ATOM 1226 N GLY B 39 2.540 6.917 -7.053 1.00 35.25 N ATOM 1227 CA GLY B 39 3.598 7.425 -6.212 1.00 39.70 C ATOM 1228 C GLY B 39 4.927 6.845 -6.474 1.00 38.82 C ATOM 1229 O GLY B 39 5.097 5.763 -7.066 1.00 37.24 O ATOM 1230 H GLY B 39 2.649 6.027 -7.579 1.00 0.00 H ATOM 1231 N LYS B 40 5.916 7.570 -5.964 1.00 36.58 N ATOM 1232 CA LYS B 40 7.285 7.168 -6.059 1.00 43.19 C ATOM 1233 C LYS B 40 7.939 7.450 -4.709 1.00 42.72 C ATOM 1234 O LYS B 40 7.609 8.424 -4.039 1.00 37.11 O ATOM 1235 CB LYS B 40 7.877 7.965 -7.203 1.00 49.84 C ATOM 1236 CG LYS B 40 9.351 8.136 -7.158 1.00 55.38 C ATOM 1237 CD LYS B 40 9.889 8.149 -8.547 1.00 57.64 C ATOM 1238 CE LYS B 40 11.396 8.062 -8.520 1.00 63.18 C ATOM 1239 NZ LYS B 40 11.825 7.280 -9.704 1.00 68.49 N ATOM 1240 HZ1 LYS B 40 11.407 6.329 -9.660 1.00 0.00 H ATOM 1241 HZ2 LYS B 40 11.506 7.760 -10.569 1.00 0.00 H ATOM 1242 HZ3 LYS B 40 12.862 7.204 -9.711 1.00 0.00 H ATOM 1243 H LYS B 40 5.687 8.461 -5.479 1.00 0.00 H ATOM 1244 N GLY B 41 8.806 6.563 -4.267 1.00 45.81 N ATOM 1245 CA GLY B 41 9.478 6.753 -2.984 1.00 49.46 C ATOM 1246 C GLY B 41 10.945 6.377 -3.111 1.00 60.60 C ATOM 1247 O GLY B 41 11.371 5.912 -4.166 1.00 70.09 O ATOM 1248 H GLY B 41 9.014 5.719 -4.837 1.00 0.00 H TER 1249 GLY B 41 ATOM 1250 N SER B 54 6.833 5.368 -15.513 1.00 74.41 N ATOM 1251 CA SER B 54 7.412 4.042 -15.473 1.00 71.23 C ATOM 1252 C SER B 54 8.100 3.662 -14.151 1.00 67.64 C ATOM 1253 O SER B 54 8.191 2.484 -13.878 1.00 67.29 O ATOM 1254 CB SER B 54 8.323 3.772 -16.671 1.00 77.11 C ATOM 1255 OG SER B 54 9.697 3.989 -16.405 1.00 80.70 O ATOM 1256 HG SER B 54 10.224 3.796 -17.220 1.00 0.00 H ATOM 1257 HN3 SER B 54 7.579 6.075 -15.355 1.00 0.00 H ATOM 1258 HN2 SER B 54 6.110 5.452 -14.770 1.00 0.00 H ATOM 1259 HN1 SER B 54 6.395 5.526 -16.443 1.00 0.00 H ATOM 1260 N ASP B 55 8.566 4.609 -13.330 1.00 62.78 N ATOM 1261 CA ASP B 55 8.980 4.275 -11.926 1.00 62.96 C ATOM 1262 C ASP B 55 7.858 4.511 -10.883 1.00 51.40 C ATOM 1263 O ASP B 55 7.922 4.179 -9.675 1.00 51.62 O ATOM 1264 CB ASP B 55 10.206 5.097 -11.540 1.00 72.73 C ATOM 1265 CG ASP B 55 11.162 4.316 -10.668 1.00 78.90 C ATOM 1266 OD1 ASP B 55 10.674 3.582 -9.799 1.00 75.40 O ATOM 1267 OD2 ASP B 55 12.389 4.438 -10.853 1.00 86.20 O ATOM 1268 H ASP B 55 8.643 5.589 -13.668 1.00 0.00 H ATOM 1269 N ILE B 56 6.818 5.149 -11.339 1.00 45.34 N ATOM 1270 CA ILE B 56 5.636 5.342 -10.510 1.00 40.06 C ATOM 1271 C ILE B 56 4.933 3.978 -10.264 1.00 37.66 C ATOM 1272 O ILE B 56 4.957 3.100 -11.123 1.00 41.07 O ATOM 1273 CB ILE B 56 4.783 6.339 -11.248 1.00 44.31 C ATOM 1274 CG1 ILE B 56 3.496 6.692 -10.597 1.00 42.65 C ATOM 1275 CG2 ILE B 56 4.455 5.828 -12.629 1.00 48.04 C ATOM 1276 CD1 ILE B 56 2.833 7.863 -11.297 1.00 49.06 C ATOM 1277 H ILE B 56 6.832 5.526 -12.308 1.00 0.00 H ATOM 1278 N GLU B 57 4.349 3.831 -9.102 1.00 36.57 N ATOM 1279 CA GLU B 57 3.570 2.676 -8.766 1.00 34.77 C ATOM 1280 C GLU B 57 2.201 3.123 -8.335 1.00 36.65 C ATOM 1281 O GLU B 57 1.930 4.310 -7.940 1.00 34.30 O ATOM 1282 CB GLU B 57 4.281 1.845 -7.768 1.00 35.91 C ATOM 1283 CG GLU B 57 5.602 1.315 -8.271 1.00 37.64 C ATOM 1284 CD GLU B 57 5.444 0.222 -9.343 1.00 39.14 C ATOM 1285 OE1 GLU B 57 4.325 -0.361 -9.416 1.00 42.29 O ATOM 1286 OE2 GLU B 57 6.409 -0.104 -10.026 1.00 42.10 O ATOM 1287 H GLU B 57 4.455 4.584 -8.393 1.00 0.00 H ATOM 1288 N ALA B 58 1.272 2.188 -8.410 1.00 34.32 N ATOM 1289 CA ALA B 58 -0.108 2.484 -8.019 1.00 34.09 C ATOM 1290 C ALA B 58 -0.197 2.280 -6.528 1.00 33.48 C ATOM 1291 O ALA B 58 0.331 1.309 -5.943 1.00 39.56 O ATOM 1292 CB ALA B 58 -1.071 1.519 -8.812 1.00 37.64 C ATOM 1293 H ALA B 58 1.521 1.237 -8.748 1.00 0.00 H ATOM 1294 N ASN B 59 -0.727 3.263 -5.838 1.00 29.49 N ATOM 1295 CA ASN B 59 -0.831 3.290 -4.364 1.00 29.78 C ATOM 1296 C ASN B 59 -2.254 3.643 -3.952 1.00 28.56 C ATOM 1297 O ASN B 59 -3.104 4.002 -4.774 1.00 30.01 O ATOM 1298 CB ASN B 59 -0.009 4.432 -3.747 1.00 29.97 C ATOM 1299 CG ASN B 59 1.475 4.213 -3.793 1.00 33.62 C ATOM 1300 OD1 ASN B 59 2.001 3.164 -4.150 1.00 34.94 O ATOM 1301 ND2 ASN B 59 2.166 5.240 -3.387 1.00 32.84 N ATOM 1302 HD22 ASN B 59 1.679 6.111 -3.093 1.00 0.00 H ATOM 1303 HD21 ASN B 59 3.204 5.189 -3.357 1.00 0.00 H ATOM 1304 H ASN B 59 -1.099 4.079 -6.365 1.00 0.00 H ATOM 1305 N ILE B 60 -2.499 3.626 -2.673 1.00 26.82 N ATOM 1306 CA ILE B 60 -3.710 4.225 -2.139 1.00 27.11 C ATOM 1307 C ILE B 60 -3.385 5.204 -1.034 1.00 27.27 C ATOM 1308 O ILE B 60 -2.375 5.091 -0.335 1.00 26.15 O ATOM 1309 CB ILE B 60 -4.711 3.208 -1.585 1.00 25.33 C ATOM 1310 CG1 ILE B 60 -3.981 2.266 -0.686 1.00 24.14 C ATOM 1311 CG2 ILE B 60 -5.389 2.434 -2.688 1.00 25.36 C ATOM 1312 CD1 ILE B 60 -4.856 1.292 0.048 1.00 25.91 C ATOM 1313 H ILE B 60 -1.819 3.178 -2.026 1.00 0.00 H ATOM 1314 N LYS B 61 -4.258 6.189 -0.897 1.00 27.90 N ATOM 1315 CA LYS B 61 -4.142 7.197 0.117 1.00 26.13 C ATOM 1316 C LYS B 61 -5.392 7.220 0.930 1.00 27.57 C ATOM 1317 O LYS B 61 -6.522 7.355 0.402 1.00 26.22 O ATOM 1318 CB LYS B 61 -3.930 8.551 -0.501 1.00 26.83 C ATOM 1319 CG LYS B 61 -3.982 9.724 0.462 1.00 28.86 C ATOM 1320 CD LYS B 61 -3.629 11.018 -0.269 1.00 32.91 C ATOM 1321 CE LYS B 61 -3.964 12.251 0.478 1.00 46.40 C ATOM 1322 NZ LYS B 61 -3.967 13.495 -0.370 1.00 47.73 N ATOM 1323 HZ1 LYS B 61 -3.023 13.632 -0.785 1.00 0.00 H ATOM 1324 HZ2 LYS B 61 -4.670 13.394 -1.130 1.00 0.00 H ATOM 1325 HZ3 LYS B 61 -4.210 14.316 0.221 1.00 0.00 H ATOM 1326 H LYS B 61 -5.064 6.234 -1.553 1.00 0.00 H ATOM 1327 N PHE B 62 -5.235 7.101 2.245 1.00 24.29 N ATOM 1328 CA PHE B 62 -6.363 7.270 3.180 1.00 24.08 C ATOM 1329 C PHE B 62 -6.244 8.629 3.885 1.00 26.11 C ATOM 1330 O PHE B 62 -5.101 9.125 4.162 1.00 23.91 O ATOM 1331 CB PHE B 62 -6.269 6.220 4.356 1.00 24.69 C ATOM 1332 CG PHE B 62 -6.641 4.815 4.012 1.00 25.18 C ATOM 1333 CD1 PHE B 62 -5.684 3.941 3.572 1.00 26.44 C ATOM 1334 CD2 PHE B 62 -7.944 4.354 4.161 1.00 27.10 C ATOM 1335 CE1 PHE B 62 -6.033 2.634 3.248 1.00 27.29 C ATOM 1336 CE2 PHE B 62 -8.249 3.027 3.904 1.00 30.86 C ATOM 1337 CZ PHE B 62 -7.286 2.168 3.466 1.00 27.30 C ATOM 1338 H PHE B 62 -4.292 6.883 2.624 1.00 0.00 H ATOM 1339 N GLU B 63 -7.393 9.235 4.155 1.00 25.21 N ATOM 1340 CA GLU B 63 -7.469 10.488 4.945 1.00 24.49 C ATOM 1341 C GLU B 63 -8.498 10.226 6.019 1.00 25.83 C ATOM 1342 O GLU B 63 -9.640 9.790 5.749 1.00 27.54 O ATOM 1343 CB GLU B 63 -7.865 11.698 4.153 1.00 27.59 C ATOM 1344 CG GLU B 63 -6.954 11.919 2.989 1.00 31.72 C ATOM 1345 CD GLU B 63 -7.427 13.111 2.134 1.00 39.04 C ATOM 1346 OE1 GLU B 63 -8.637 13.158 1.766 1.00 40.74 O ATOM 1347 OE2 GLU B 63 -6.580 13.950 1.917 1.00 43.79 O ATOM 1348 H GLU B 63 -8.275 8.815 3.799 1.00 0.00 H ATOM 1349 N ILE B 64 -8.073 10.420 7.282 1.00 26.13 N ATOM 1350 CA ILE B 64 -8.941 10.146 8.369 1.00 25.80 C ATOM 1351 C ILE B 64 -8.953 11.353 9.300 1.00 27.17 C ATOM 1352 O ILE B 64 -7.895 11.755 9.783 1.00 28.22 O ATOM 1353 CB ILE B 64 -8.524 8.904 9.200 1.00 27.51 C ATOM 1354 CG1 ILE B 64 -8.247 7.664 8.329 1.00 27.35 C ATOM 1355 CG2 ILE B 64 -9.578 8.598 10.270 1.00 27.84 C ATOM 1356 CD1 ILE B 64 -6.789 7.430 8.075 1.00 26.34 C ATOM 1357 H ILE B 64 -7.110 10.770 7.460 1.00 0.00 H ATOM 1358 N LEU B 65 -10.127 11.939 9.530 1.00 27.11 N ATOM 1359 CA LEU B 65 -10.239 13.083 10.472 1.00 29.31 C ATOM 1360 C LEU B 65 -10.572 12.477 11.828 1.00 29.38 C ATOM 1361 O LEU B 65 -11.545 11.719 11.947 1.00 30.70 O ATOM 1362 CB LEU B 65 -11.334 14.070 10.070 1.00 30.66 C ATOM 1363 CG LEU B 65 -11.064 14.982 8.859 1.00 31.09 C ATOM 1364 CD1 LEU B 65 -12.412 15.502 8.417 1.00 36.21 C ATOM 1365 CD2 LEU B 65 -10.069 16.110 9.126 1.00 30.97 C ATOM 1366 H LEU B 65 -10.978 11.591 9.043 1.00 0.00 H ATOM 1367 N THR B 66 -9.764 12.813 12.854 1.00 31.09 N ATOM 1368 CA THR B 66 -10.028 12.327 14.209 1.00 32.37 C ATOM 1369 C THR B 66 -10.226 13.526 15.168 1.00 33.49 C ATOM 1370 O THR B 66 -9.605 14.599 15.008 1.00 33.48 O ATOM 1371 CB THR B 66 -8.879 11.418 14.724 1.00 33.29 C ATOM 1372 OG1 THR B 66 -7.667 12.192 14.860 1.00 31.92 O ATOM 1373 CG2 THR B 66 -8.602 10.271 13.749 1.00 33.36 C ATOM 1374 HG1 THR B 66 -7.817 12.928 15.505 1.00 0.00 H ATOM 1375 H THR B 66 -8.942 13.426 12.680 1.00 0.00 H ATOM 1376 N GLU B 67 -11.039 13.346 16.203 1.00 36.29 N ATOM 1377 CA GLU B 67 -11.197 14.388 17.218 1.00 42.87 C ATOM 1378 C GLU B 67 -9.940 14.606 18.083 1.00 43.48 C ATOM 1379 O GLU B 67 -9.682 15.718 18.530 1.00 44.36 O ATOM 1380 CB GLU B 67 -12.380 14.052 18.116 1.00 48.66 C ATOM 1381 CG GLU B 67 -12.456 14.899 19.386 1.00 60.19 C ATOM 1382 CD GLU B 67 -13.694 14.612 20.216 1.00 64.62 C ATOM 1383 OE1 GLU B 67 -13.572 14.490 21.445 1.00 67.05 O ATOM 1384 OE2 GLU B 67 -14.791 14.504 19.626 1.00 70.97 O ATOM 1385 H GLU B 67 -11.569 12.455 16.293 1.00 0.00 H ATOM 1386 N THR B 68 -9.138 13.582 18.273 1.00 40.88 N ATOM 1387 CA THR B 68 -7.957 13.685 19.129 1.00 39.39 C ATOM 1388 C THR B 68 -6.709 13.240 18.365 1.00 39.07 C ATOM 1389 O THR B 68 -6.728 12.376 17.430 1.00 34.19 O ATOM 1390 CB THR B 68 -8.098 12.792 20.377 1.00 41.55 C ATOM 1391 OG1 THR B 68 -8.025 11.399 20.028 1.00 37.68 O ATOM 1392 CG2 THR B 68 -9.425 13.041 21.145 1.00 45.72 C ATOM 1393 HG1 THR B 68 -8.755 11.179 19.397 1.00 0.00 H ATOM 1394 H THR B 68 -9.348 12.678 17.804 1.00 0.00 H ATOM 1395 N ARG B 69 -5.585 13.787 18.779 1.00 38.10 N ATOM 1396 CA ARG B 69 -4.319 13.402 18.230 1.00 40.29 C ATOM 1397 C ARG B 69 -4.025 11.954 18.626 1.00 38.75 C ATOM 1398 O ARG B 69 -3.455 11.235 17.838 1.00 36.49 O ATOM 1399 CB ARG B 69 -3.266 14.342 18.781 1.00 44.71 C ATOM 1400 CG ARG B 69 -1.835 13.917 18.568 1.00 48.50 C ATOM 1401 CD ARG B 69 -1.381 14.154 17.189 1.00 49.74 C ATOM 1402 NE ARG B 69 0.091 14.077 17.063 1.00 52.15 N ATOM 1403 CZ ARG B 69 0.866 14.988 16.478 1.00 49.43 C ATOM 1404 NH1 ARG B 69 0.376 16.121 15.991 1.00 48.77 N ATOM 1405 NH2 ARG B 69 2.147 14.753 16.352 1.00 49.57 N ATOM 1406 HE ARG B 69 0.560 13.241 17.465 1.00 0.00 H ATOM 1407 HH12 ARG B 69 1.011 16.811 15.540 1.00 0.00 H ATOM 1408 HH11 ARG B 69 -0.643 16.319 16.060 1.00 0.00 H ATOM 1409 HH22 ARG B 69 2.763 15.457 15.897 1.00 0.00 H ATOM 1410 HH21 ARG B 69 2.550 13.862 16.707 1.00 0.00 H ATOM 1411 H ARG B 69 -5.617 14.515 19.521 1.00 0.00 H ATOM 1412 N GLU B 70 -4.466 11.553 19.826 1.00 37.75 N ATOM 1413 CA GLU B 70 -4.208 10.189 20.309 1.00 40.92 C ATOM 1414 C GLU B 70 -4.861 9.134 19.471 1.00 36.67 C ATOM 1415 O GLU B 70 -4.240 8.069 19.207 1.00 34.31 O ATOM 1416 CB GLU B 70 -4.646 10.023 21.753 1.00 45.86 C ATOM 1417 CG GLU B 70 -3.832 10.864 22.727 1.00 56.27 C ATOM 1418 CD GLU B 70 -3.988 12.400 22.682 1.00 61.29 C ATOM 1419 OE1 GLU B 70 -3.011 13.057 23.144 1.00 67.62 O ATOM 1420 OE2 GLU B 70 -5.023 12.981 22.231 1.00 51.89 O ATOM 1421 H GLU B 70 -4.999 12.216 20.424 1.00 0.00 H ATOM 1422 N MET B 71 -6.075 9.407 18.989 1.00 35.10 N ATOM 1423 CA MET B 71 -6.721 8.445 18.092 1.00 34.63 C ATOM 1424 C MET B 71 -5.964 8.339 16.777 1.00 30.91 C ATOM 1425 O MET B 71 -5.794 7.218 16.243 1.00 29.90 O ATOM 1426 CB MET B 71 -8.186 8.805 17.842 1.00 37.33 C ATOM 1427 CG MET B 71 -8.910 7.875 16.900 1.00 34.90 C ATOM 1428 SD MET B 71 -10.636 8.387 16.650 1.00 41.66 S ATOM 1429 CE MET B 71 -11.336 7.786 18.153 1.00 46.75 C ATOM 1430 H MET B 71 -6.557 10.292 19.247 1.00 0.00 H ATOM 1431 N ALA B 72 -5.538 9.489 16.247 1.00 30.80 N ATOM 1432 CA ALA B 72 -4.783 9.483 14.986 1.00 29.53 C ATOM 1433 C ALA B 72 -3.521 8.677 15.179 1.00 32.47 C ATOM 1434 O ALA B 72 -3.165 7.920 14.298 1.00 28.62 O ATOM 1435 CB ALA B 72 -4.448 10.878 14.549 1.00 31.08 C ATOM 1436 H ALA B 72 -5.741 10.389 16.727 1.00 0.00 H ATOM 1437 N GLU B 73 -2.820 8.892 16.307 1.00 28.75 N ATOM 1438 CA GLU B 73 -1.558 8.170 16.524 1.00 30.34 C ATOM 1439 C GLU B 73 -1.783 6.659 16.727 1.00 28.88 C ATOM 1440 O GLU B 73 -0.951 5.871 16.303 1.00 30.62 O ATOM 1441 CB GLU B 73 -0.733 8.814 17.673 1.00 34.41 C ATOM 1442 CG GLU B 73 -0.163 10.159 17.249 1.00 40.07 C ATOM 1443 CD GLU B 73 0.881 10.683 18.215 1.00 50.25 C ATOM 1444 OE1 GLU B 73 1.397 9.846 18.982 1.00 61.71 O ATOM 1445 OE2 GLU B 73 1.137 11.905 18.250 1.00 48.81 O ATOM 1446 H GLU B 73 -3.168 9.564 17.020 1.00 0.00 H ATOM 1447 N GLU B 74 -2.871 6.240 17.364 1.00 33.25 N ATOM 1448 CA GLU B 74 -3.207 4.847 17.487 1.00 34.36 C ATOM 1449 C GLU B 74 -3.306 4.167 16.108 1.00 31.26 C ATOM 1450 O GLU B 74 -2.779 3.052 15.899 1.00 30.16 O ATOM 1451 CB GLU B 74 -4.526 4.616 18.237 1.00 37.74 C ATOM 1452 CG GLU B 74 -4.970 3.128 18.183 1.00 44.78 C ATOM 1453 CD GLU B 74 -6.255 2.826 18.941 1.00 53.25 C ATOM 1454 OE1 GLU B 74 -7.161 2.135 18.409 1.00 53.80 O ATOM 1455 OE2 GLU B 74 -6.381 3.337 20.055 1.00 55.74 O ATOM 1456 H GLU B 74 -3.504 6.947 17.790 1.00 0.00 H ATOM 1457 N ILE B 75 -4.036 4.807 15.184 1.00 29.04 N ATOM 1458 CA ILE B 75 -4.137 4.251 13.875 1.00 28.14 C ATOM 1459 C ILE B 75 -2.753 4.159 13.210 1.00 26.24 C ATOM 1460 O ILE B 75 -2.426 3.123 12.621 1.00 25.75 O ATOM 1461 CB ILE B 75 -5.068 5.119 13.013 1.00 27.25 C ATOM 1462 CG1 ILE B 75 -6.473 5.110 13.577 1.00 30.37 C ATOM 1463 CG2 ILE B 75 -5.055 4.669 11.557 1.00 28.02 C ATOM 1464 CD1 ILE B 75 -7.342 6.241 13.003 1.00 31.93 C ATOM 1465 H ILE B 75 -4.522 5.696 15.418 1.00 0.00 H ATOM 1466 N ALA B 76 -2.022 5.272 13.222 1.00 24.55 N ATOM 1467 CA ALA B 76 -0.679 5.354 12.604 1.00 23.67 C ATOM 1468 C ALA B 76 0.230 4.270 13.175 1.00 24.65 C ATOM 1469 O ALA B 76 0.834 3.543 12.427 1.00 25.67 O ATOM 1470 CB ALA B 76 -0.037 6.689 12.807 1.00 24.90 C ATOM 1471 H ALA B 76 -2.410 6.119 13.685 1.00 0.00 H ATOM 1472 N ASP B 77 0.273 4.157 14.483 1.00 26.22 N ATOM 1473 CA ASP B 77 1.181 3.244 15.190 1.00 27.34 C ATOM 1474 C ASP B 77 0.815 1.796 14.811 1.00 28.18 C ATOM 1475 O ASP B 77 1.702 0.991 14.638 1.00 28.92 O ATOM 1476 CB ASP B 77 1.074 3.419 16.707 1.00 30.48 C ATOM 1477 CG ASP B 77 1.733 4.691 17.206 1.00 30.76 C ATOM 1478 OD1 ASP B 77 2.430 5.386 16.463 1.00 32.35 O ATOM 1479 OD2 ASP B 77 1.581 4.957 18.409 1.00 33.75 O ATOM 1480 H ASP B 77 -0.371 4.746 15.049 1.00 0.00 H ATOM 1481 N ARG B 78 -0.483 1.486 14.716 1.00 27.79 N ATOM 1482 CA ARG B 78 -0.966 0.105 14.465 1.00 29.75 C ATOM 1483 C ARG B 78 -0.674 -0.313 13.030 1.00 26.75 C ATOM 1484 O ARG B 78 -0.173 -1.426 12.787 1.00 28.37 O ATOM 1485 CB ARG B 78 -2.468 -0.105 14.743 1.00 33.31 C ATOM 1486 CG ARG B 78 -2.943 -0.366 16.148 1.00 42.12 C ATOM 1487 CD ARG B 78 -4.340 -0.982 16.062 1.00 39.94 C ATOM 1488 NE ARG B 78 -4.440 -2.408 16.130 1.00 38.30 N ATOM 1489 CZ ARG B 78 -5.533 -3.065 15.800 1.00 40.40 C ATOM 1490 NH1 ARG B 78 -6.610 -2.405 15.366 1.00 42.16 N ATOM 1491 NH2 ARG B 78 -5.586 -4.348 15.913 1.00 39.71 N ATOM 1492 HE ARG B 78 -3.613 -2.949 16.454 1.00 0.00 H ATOM 1493 HH12 ARG B 78 -7.471 -2.928 15.107 1.00 0.00 H ATOM 1494 HH11 ARG B 78 -6.588 -1.368 15.287 1.00 0.00 H ATOM 1495 HH22 ARG B 78 -6.453 -4.858 15.650 1.00 0.00 H ATOM 1496 HH21 ARG B 78 -4.761 -4.873 16.267 1.00 0.00 H ATOM 1497 H ARG B 78 -1.185 2.246 14.823 1.00 0.00 H ATOM 1498 N VAL B 79 -0.921 0.610 12.095 1.00 26.79 N ATOM 1499 CA VAL B 79 -0.582 0.352 10.707 1.00 26.96 C ATOM 1500 C VAL B 79 0.902 0.128 10.541 1.00 26.25 C ATOM 1501 O VAL B 79 1.373 -0.838 9.936 1.00 27.05 O ATOM 1502 CB VAL B 79 -1.062 1.496 9.812 1.00 26.15 C ATOM 1503 CG1 VAL B 79 -0.537 1.264 8.364 1.00 27.50 C ATOM 1504 CG2 VAL B 79 -2.571 1.608 9.845 1.00 25.97 C ATOM 1505 H VAL B 79 -1.357 1.515 12.363 1.00 0.00 H ATOM 1506 N ALA B 80 1.709 1.051 11.103 1.00 26.95 N ATOM 1507 CA ALA B 80 3.132 0.975 10.914 1.00 27.37 C ATOM 1508 C ALA B 80 3.744 -0.252 11.542 1.00 30.79 C ATOM 1509 O ALA B 80 4.611 -0.947 10.899 1.00 29.90 O ATOM 1510 CB ALA B 80 3.828 2.246 11.447 1.00 30.65 C ATOM 1511 H ALA B 80 1.301 1.819 11.674 1.00 0.00 H ATOM 1512 N VAL B 81 3.363 -0.558 12.798 1.00 30.26 N ATOM 1513 CA VAL B 81 3.997 -1.705 13.471 1.00 31.89 C ATOM 1514 C VAL B 81 3.665 -3.008 12.728 1.00 31.66 C ATOM 1515 O VAL B 81 4.436 -3.939 12.688 1.00 32.35 O ATOM 1516 CB VAL B 81 3.637 -1.739 14.990 1.00 33.59 C ATOM 1517 CG1 VAL B 81 2.192 -2.183 15.203 1.00 33.77 C ATOM 1518 CG2 VAL B 81 4.557 -2.666 15.745 1.00 38.52 C ATOM 1519 H VAL B 81 2.635 0.005 13.283 1.00 0.00 H ATOM 1520 N LYS B 82 2.480 -3.090 12.159 1.00 30.19 N ATOM 1521 CA LYS B 82 2.036 -4.311 11.493 1.00 31.72 C ATOM 1522 C LYS B 82 2.609 -4.489 10.088 1.00 34.07 C ATOM 1523 O LYS B 82 2.904 -5.610 9.669 1.00 33.95 O ATOM 1524 CB LYS B 82 0.509 -4.326 11.432 1.00 30.97 C ATOM 1525 CG LYS B 82 -0.137 -4.646 12.758 1.00 31.98 C ATOM 1526 CD LYS B 82 -1.634 -4.536 12.688 1.00 33.25 C ATOM 1527 CE LYS B 82 -2.372 -4.579 14.014 1.00 33.73 C ATOM 1528 NZ LYS B 82 -2.256 -5.868 14.609 1.00 36.90 N ATOM 1529 HZ1 LYS B 82 -2.665 -6.581 13.971 1.00 0.00 H ATOM 1530 HZ2 LYS B 82 -1.252 -6.083 14.774 1.00 0.00 H ATOM 1531 HZ3 LYS B 82 -2.767 -5.878 15.515 1.00 0.00 H ATOM 1532 H LYS B 82 1.846 -2.266 12.185 1.00 0.00 H ATOM 1533 N TYR B 83 2.723 -3.389 9.357 1.00 29.86 N ATOM 1534 CA TYR B 83 2.956 -3.446 7.907 1.00 34.21 C ATOM 1535 C TYR B 83 4.173 -2.704 7.375 1.00 35.00 C ATOM 1536 O TYR B 83 4.648 -3.030 6.245 1.00 35.41 O ATOM 1537 CB TYR B 83 1.675 -3.000 7.166 1.00 31.02 C ATOM 1538 CG TYR B 83 0.519 -3.829 7.585 1.00 32.81 C ATOM 1539 CD1 TYR B 83 0.533 -5.205 7.385 1.00 38.58 C ATOM 1540 CD2 TYR B 83 -0.599 -3.263 8.152 1.00 33.88 C ATOM 1541 CE1 TYR B 83 -0.516 -5.993 7.769 1.00 40.39 C ATOM 1542 CE2 TYR B 83 -1.638 -4.072 8.595 1.00 35.86 C ATOM 1543 CZ TYR B 83 -1.604 -5.399 8.352 1.00 40.24 C ATOM 1544 OH TYR B 83 -2.640 -6.154 8.772 1.00 48.42 O ATOM 1545 HH TYR B 83 -2.725 -6.077 9.755 1.00 0.00 H ATOM 1546 H TYR B 83 2.646 -2.462 9.822 1.00 0.00 H ATOM 1547 N PHE B 84 4.684 -1.709 8.084 1.00 33.07 N ATOM 1548 CA PHE B 84 5.686 -0.861 7.419 1.00 31.93 C ATOM 1549 C PHE B 84 7.082 -1.474 7.363 1.00 37.45 C ATOM 1550 O PHE B 84 7.962 -0.869 6.788 1.00 35.62 O ATOM 1551 CB PHE B 84 5.768 0.563 7.954 1.00 32.53 C ATOM 1552 CG PHE B 84 4.700 1.486 7.379 1.00 31.30 C ATOM 1553 CD1 PHE B 84 3.655 0.989 6.617 1.00 29.79 C ATOM 1554 CD2 PHE B 84 4.752 2.839 7.601 1.00 32.10 C ATOM 1555 CE1 PHE B 84 2.652 1.805 6.133 1.00 31.76 C ATOM 1556 CE2 PHE B 84 3.755 3.642 7.079 1.00 32.12 C ATOM 1557 CZ PHE B 84 2.721 3.117 6.365 1.00 31.72 C ATOM 1558 H PHE B 84 4.390 -1.535 9.066 1.00 0.00 H ATOM 1559 N ASN B 85 7.274 -2.655 7.933 1.00 38.00 N ATOM 1560 CA ASN B 85 8.500 -3.431 7.696 1.00 40.13 C ATOM 1561 C ASN B 85 8.479 -4.090 6.345 1.00 43.10 C ATOM 1562 O ASN B 85 9.521 -4.309 5.732 1.00 45.80 O ATOM 1563 CB ASN B 85 8.698 -4.483 8.813 1.00 41.65 C ATOM 1564 CG ASN B 85 9.466 -3.903 9.963 1.00 46.14 C ATOM 1565 OD1 ASN B 85 9.254 -2.758 10.293 1.00 51.82 O ATOM 1566 ND2 ASN B 85 10.472 -4.618 10.469 1.00 52.38 N ATOM 1567 HD22 ASN B 85 10.620 -5.600 10.159 1.00 0.00 H ATOM 1568 HD21 ASN B 85 11.108 -4.194 11.174 1.00 0.00 H ATOM 1569 H ASN B 85 6.541 -3.041 8.562 1.00 0.00 H ATOM 1570 N ASP B 86 7.299 -4.411 5.866 1.00 40.58 N ATOM 1571 CA ASP B 86 7.168 -5.166 4.639 1.00 45.81 C ATOM 1572 C ASP B 86 6.624 -4.378 3.480 1.00 47.29 C ATOM 1573 O ASP B 86 6.682 -4.887 2.370 1.00 43.27 O ATOM 1574 CB ASP B 86 6.234 -6.332 4.874 1.00 46.79 C ATOM 1575 CG ASP B 86 6.813 -7.310 5.835 1.00 51.21 C ATOM 1576 OD1 ASP B 86 7.854 -7.865 5.514 1.00 57.67 O ATOM 1577 OD2 ASP B 86 6.252 -7.467 6.922 1.00 56.62 O ATOM 1578 H ASP B 86 6.443 -4.117 6.378 1.00 0.00 H ATOM 1579 N TYR B 87 6.006 -3.207 3.737 1.00 39.16 N ATOM 1580 CA TYR B 87 5.292 -2.497 2.694 1.00 39.68 C ATOM 1581 C TYR B 87 5.724 -1.066 2.727 1.00 39.14 C ATOM 1582 O TYR B 87 5.982 -0.489 3.797 1.00 35.41 O ATOM 1583 CB TYR B 87 3.774 -2.659 2.826 1.00 41.07 C ATOM 1584 CG TYR B 87 3.285 -4.063 2.655 1.00 42.51 C ATOM 1585 CD1 TYR B 87 2.996 -4.582 1.390 1.00 44.86 C ATOM 1586 CD2 TYR B 87 3.132 -4.915 3.750 1.00 40.71 C ATOM 1587 CE1 TYR B 87 2.583 -5.890 1.245 1.00 47.72 C ATOM 1588 CE2 TYR B 87 2.708 -6.219 3.615 1.00 46.38 C ATOM 1589 CZ TYR B 87 2.437 -6.706 2.351 1.00 48.77 C ATOM 1590 OH TYR B 87 2.001 -7.983 2.186 1.00 48.64 O ATOM 1591 HH TYR B 87 1.859 -8.160 1.222 1.00 0.00 H ATOM 1592 H TYR B 87 6.042 -2.808 4.697 1.00 0.00 H ATOM 1593 N ALA B 88 5.786 -0.442 1.555 1.00 40.69 N ATOM 1594 CA ALA B 88 6.151 0.970 1.449 1.00 36.98 C ATOM 1595 C ALA B 88 5.060 1.814 2.019 1.00 33.27 C ATOM 1596 O ALA B 88 3.904 1.502 1.823 1.00 33.37 O ATOM 1597 CB ALA B 88 6.393 1.355 0.003 1.00 39.43 C ATOM 1598 H ALA B 88 5.569 -0.974 0.688 1.00 0.00 H ATOM 1599 N GLY B 89 5.421 2.922 2.651 1.00 32.60 N ATOM 1600 CA GLY B 89 4.349 3.808 3.148 1.00 33.89 C ATOM 1601 C GLY B 89 4.838 5.045 3.825 1.00 31.99 C ATOM 1602 O GLY B 89 6.013 5.107 4.294 1.00 34.79 O ATOM 1603 H GLY B 89 6.424 3.159 2.792 1.00 0.00 H ATOM 1604 N ILE B 90 3.958 6.038 3.894 1.00 25.67 N ATOM 1605 CA ILE B 90 4.200 7.220 4.665 1.00 26.86 C ATOM 1606 C ILE B 90 2.933 7.588 5.392 1.00 27.62 C ATOM 1607 O ILE B 90 1.827 7.431 4.870 1.00 26.72 O ATOM 1608 CB ILE B 90 4.743 8.395 3.804 1.00 28.57 C ATOM 1609 CG1 ILE B 90 5.210 9.604 4.652 1.00 29.94 C ATOM 1610 CG2 ILE B 90 3.735 8.944 2.788 1.00 29.98 C ATOM 1611 CD1 ILE B 90 6.034 10.612 3.949 1.00 34.59 C ATOM 1612 H ILE B 90 3.063 5.954 3.370 1.00 0.00 H ATOM 1613 N ILE B 91 3.082 8.147 6.607 1.00 25.50 N ATOM 1614 CA ILE B 91 1.941 8.591 7.387 1.00 25.60 C ATOM 1615 C ILE B 91 2.268 9.894 8.012 1.00 26.12 C ATOM 1616 O ILE B 91 3.358 10.060 8.655 1.00 27.35 O ATOM 1617 CB ILE B 91 1.621 7.582 8.531 1.00 26.22 C ATOM 1618 CG1 ILE B 91 1.373 6.174 8.017 1.00 27.43 C ATOM 1619 CG2 ILE B 91 0.467 8.035 9.355 1.00 25.99 C ATOM 1620 CD1 ILE B 91 1.084 5.139 9.054 1.00 27.76 C ATOM 1621 H ILE B 91 4.039 8.264 6.997 1.00 0.00 H ATOM 1622 N TYR B 92 1.357 10.842 7.830 1.00 24.43 N ATOM 1623 CA TYR B 92 1.539 12.174 8.336 1.00 26.09 C ATOM 1624 C TYR B 92 0.273 12.747 8.817 1.00 26.50 C ATOM 1625 O TYR B 92 -0.817 12.261 8.524 1.00 26.13 O ATOM 1626 CB TYR B 92 2.203 13.068 7.312 1.00 27.25 C ATOM 1627 CG TYR B 92 1.479 13.258 6.018 1.00 28.41 C ATOM 1628 CD1 TYR B 92 1.674 12.403 4.961 1.00 29.39 C ATOM 1629 CD2 TYR B 92 0.634 14.355 5.869 1.00 29.50 C ATOM 1630 CE1 TYR B 92 1.052 12.631 3.729 1.00 29.79 C ATOM 1631 CE2 TYR B 92 0.007 14.593 4.647 1.00 31.30 C ATOM 1632 CZ TYR B 92 0.228 13.755 3.608 1.00 29.58 C ATOM 1633 OH TYR B 92 -0.408 13.993 2.394 1.00 35.43 O ATOM 1634 HH TYR B 92 -0.144 13.296 1.742 1.00 0.00 H ATOM 1635 H TYR B 92 0.488 10.614 7.307 1.00 0.00 H ATOM 1636 N ILE B 93 0.384 13.799 9.579 1.00 26.49 N ATOM 1637 CA ILE B 93 -0.758 14.363 10.224 1.00 27.74 C ATOM 1638 C ILE B 93 -0.733 15.921 10.015 1.00 32.02 C ATOM 1639 O ILE B 93 0.344 16.590 9.996 1.00 30.50 O ATOM 1640 CB ILE B 93 -0.761 13.875 11.721 1.00 32.79 C ATOM 1641 CG1 ILE B 93 -2.031 14.201 12.454 1.00 38.67 C ATOM 1642 CG2 ILE B 93 0.436 14.416 12.480 1.00 36.13 C ATOM 1643 CD1 ILE B 93 -2.038 13.387 13.776 1.00 41.04 C ATOM 1644 H ILE B 93 1.318 14.234 9.719 1.00 0.00 H ATOM 1645 N CYS B 94 -1.919 16.499 9.865 1.00 32.82 N ATOM 1646 CA CYS B 94 -2.123 17.983 9.582 1.00 38.48 C ATOM 1647 C CYS B 94 -3.217 18.379 10.561 1.00 36.45 C ATOM 1648 O CYS B 94 -4.010 17.555 10.939 1.00 34.67 O ATOM 1649 CB CYS B 94 -2.659 18.235 8.104 1.00 36.67 C ATOM 1650 SG CYS B 94 -1.421 17.688 6.842 1.00 49.40 S ATOM 1651 H CYS B 94 -2.765 15.899 9.946 1.00 0.00 H ATOM 1652 N SER B 95 -3.309 19.645 10.934 1.00 36.13 N ATOM 1653 CA SER B 95 -4.378 20.140 11.755 1.00 34.97 C ATOM 1654 C SER B 95 -5.491 20.513 10.760 1.00 34.66 C ATOM 1655 O SER B 95 -5.245 20.888 9.643 1.00 36.74 O ATOM 1656 CB SER B 95 -3.973 21.487 12.445 1.00 39.62 C ATOM 1657 OG SER B 95 -3.012 21.192 13.470 1.00 50.87 O ATOM 1658 HG SER B 95 -2.742 22.032 13.919 1.00 0.00 H ATOM 1659 H SER B 95 -2.575 20.311 10.619 1.00 0.00 H ATOM 1660 N ALA B 96 -6.705 20.463 11.227 1.00 34.76 N ATOM 1661 CA ALA B 96 -7.875 20.849 10.467 1.00 32.09 C ATOM 1662 C ALA B 96 -8.967 21.245 11.422 1.00 30.98 C ATOM 1663 O ALA B 96 -8.873 21.032 12.665 1.00 32.79 O ATOM 1664 CB ALA B 96 -8.311 19.661 9.668 1.00 29.28 C ATOM 1665 H ALA B 96 -6.842 20.127 12.201 1.00 0.00 H ATOM 1666 N GLU B 97 -9.985 21.915 10.906 1.00 30.97 N ATOM 1667 CA GLU B 97 -11.140 22.248 11.669 1.00 31.12 C ATOM 1668 C GLU B 97 -12.305 21.713 10.828 1.00 34.45 C ATOM 1669 O GLU B 97 -12.388 22.050 9.664 1.00 31.50 O ATOM 1670 CB GLU B 97 -11.309 23.717 11.765 1.00 36.15 C ATOM 1671 CG GLU B 97 -10.362 24.470 12.660 1.00 40.04 C ATOM 1672 CD GLU B 97 -10.468 25.955 12.393 1.00 42.58 C ATOM 1673 OE1 GLU B 97 -9.661 26.474 11.569 1.00 44.32 O ATOM 1674 OE2 GLU B 97 -11.398 26.593 12.933 1.00 45.58 O ATOM 1675 H GLU B 97 -9.940 22.208 9.909 1.00 0.00 H ATOM 1676 N VAL B 98 -13.201 20.935 11.430 1.00 32.82 N ATOM 1677 CA VAL B 98 -14.408 20.444 10.772 1.00 32.06 C ATOM 1678 C VAL B 98 -15.562 21.419 10.953 1.00 32.91 C ATOM 1679 O VAL B 98 -15.905 21.844 12.119 1.00 35.27 O ATOM 1680 CB VAL B 98 -14.758 19.021 11.303 1.00 32.99 C ATOM 1681 CG1 VAL B 98 -16.066 18.537 10.677 1.00 34.25 C ATOM 1682 CG2 VAL B 98 -13.618 18.099 11.098 1.00 32.28 C ATOM 1683 H VAL B 98 -13.033 20.663 12.420 1.00 0.00 H ATOM 1684 N LEU B 99 -16.135 21.872 9.824 1.00 30.79 N ATOM 1685 CA LEU B 99 -17.191 22.808 9.781 1.00 35.47 C ATOM 1686 C LEU B 99 -18.534 22.115 9.835 1.00 36.79 C ATOM 1687 O LEU B 99 -19.435 22.627 10.465 1.00 36.55 O ATOM 1688 CB LEU B 99 -17.068 23.683 8.534 1.00 35.66 C ATOM 1689 CG LEU B 99 -15.761 24.508 8.503 1.00 37.73 C ATOM 1690 CD1 LEU B 99 -15.696 25.330 7.217 1.00 37.56 C ATOM 1691 CD2 LEU B 99 -15.613 25.428 9.733 1.00 41.54 C ATOM 1692 H LEU B 99 -15.775 21.507 8.919 1.00 0.00 H ATOM 1693 N TYR B 100 -18.677 20.995 9.104 1.00 35.16 N ATOM 1694 CA TYR B 100 -19.957 20.253 9.012 1.00 37.77 C ATOM 1695 C TYR B 100 -19.606 18.788 8.910 1.00 36.79 C ATOM 1696 O TYR B 100 -18.685 18.396 8.187 1.00 34.18 O ATOM 1697 CB TYR B 100 -20.792 20.641 7.774 1.00 39.10 C ATOM 1698 CG TYR B 100 -21.306 22.029 7.861 1.00 40.36 C ATOM 1699 CD1 TYR B 100 -22.451 22.301 8.602 1.00 41.65 C ATOM 1700 CD2 TYR B 100 -20.612 23.089 7.245 1.00 37.99 C ATOM 1701 CE1 TYR B 100 -22.927 23.582 8.721 1.00 44.84 C ATOM 1702 CE2 TYR B 100 -21.058 24.379 7.381 1.00 39.87 C ATOM 1703 CZ TYR B 100 -22.237 24.610 8.128 1.00 42.78 C ATOM 1704 OH TYR B 100 -22.742 25.830 8.265 1.00 43.23 O ATOM 1705 HH TYR B 100 -22.076 26.414 8.707 1.00 0.00 H ATOM 1706 H TYR B 100 -17.854 20.634 8.581 1.00 0.00 H ATOM 1707 N GLY B 101 -20.350 17.975 9.638 1.00 36.65 N ATOM 1708 CA GLY B 101 -20.147 16.543 9.597 1.00 37.93 C ATOM 1709 C GLY B 101 -21.006 15.873 10.663 1.00 41.95 C ATOM 1710 O GLY B 101 -20.612 15.817 11.818 1.00 41.81 O ATOM 1711 H GLY B 101 -21.093 18.370 10.250 1.00 0.00 H ATOM 1712 N HIS B 102 -22.160 15.357 10.248 1.00 46.41 N ATOM 1713 CA HIS B 102 -23.143 14.788 11.188 1.00 51.78 C ATOM 1714 C HIS B 102 -22.501 13.730 12.094 1.00 47.07 C ATOM 1715 O HIS B 102 -22.656 13.812 13.296 1.00 48.44 O ATOM 1716 CB HIS B 102 -24.401 14.239 10.488 1.00 55.89 C ATOM 1717 CG HIS B 102 -25.317 15.298 9.950 1.00 69.24 C ATOM 1718 ND1 HIS B 102 -25.623 16.454 10.643 1.00 74.84 N ATOM 1719 CD2 HIS B 102 -26.010 15.368 8.786 1.00 74.90 C ATOM 1720 CE1 HIS B 102 -26.441 17.197 9.918 1.00 76.12 C ATOM 1721 NE2 HIS B 102 -26.693 16.559 8.789 1.00 73.09 N ATOM 1722 H HIS B 102 -22.375 15.355 9.230 1.00 0.00 H ATOM 1723 N THR B 103 -21.733 12.789 11.574 1.00 45.17 N ATOM 1724 CA THR B 103 -21.118 11.814 12.490 1.00 48.59 C ATOM 1725 C THR B 103 -19.906 12.367 13.228 1.00 47.10 C ATOM 1726 O THR B 103 -19.659 12.004 14.372 1.00 46.50 O ATOM 1727 CB THR B 103 -20.744 10.458 11.838 1.00 48.28 C ATOM 1728 OG1 THR B 103 -19.723 10.663 10.861 1.00 49.66 O ATOM 1729 CG2 THR B 103 -21.939 9.853 11.182 1.00 51.93 C ATOM 1730 HG1 THR B 103 -18.923 11.051 11.297 1.00 0.00 H ATOM 1731 H THR B 103 -21.568 12.739 10.548 1.00 0.00 H ATOM 1732 N PHE B 104 -19.125 13.225 12.595 1.00 41.21 N ATOM 1733 CA PHE B 104 -17.961 13.744 13.288 1.00 39.72 C ATOM 1734 C PHE B 104 -18.370 14.680 14.462 1.00 41.61 C ATOM 1735 O PHE B 104 -17.799 14.627 15.562 1.00 42.42 O ATOM 1736 CB PHE B 104 -17.049 14.528 12.346 1.00 37.48 C ATOM 1737 CG PHE B 104 -15.733 14.903 12.966 1.00 35.48 C ATOM 1738 CD1 PHE B 104 -14.707 14.018 12.954 1.00 35.76 C ATOM 1739 CD2 PHE B 104 -15.552 16.117 13.553 1.00 35.55 C ATOM 1740 CE1 PHE B 104 -13.503 14.323 13.526 1.00 35.36 C ATOM 1741 CE2 PHE B 104 -14.328 16.438 14.114 1.00 36.21 C ATOM 1742 CZ PHE B 104 -13.317 15.526 14.116 1.00 33.81 C ATOM 1743 H PHE B 104 -19.340 13.522 11.622 1.00 0.00 H ATOM 1744 N CYS B 105 -19.284 15.582 14.215 1.00 41.26 N ATOM 1745 CA CYS B 105 -19.600 16.604 15.221 1.00 46.93 C ATOM 1746 C CYS B 105 -20.743 16.243 16.126 1.00 50.61 C ATOM 1747 O CYS B 105 -20.940 16.890 17.164 1.00 53.77 O ATOM 1748 CB CYS B 105 -19.917 17.942 14.561 1.00 47.48 C ATOM 1749 SG CYS B 105 -18.465 18.602 13.690 1.00 43.74 S ATOM 1750 H CYS B 105 -19.788 15.576 13.305 1.00 0.00 H ATOM 1751 N GLY B 106 -21.532 15.259 15.717 1.00 50.63 N ATOM 1752 CA GLY B 106 -22.711 14.880 16.487 1.00 54.86 C ATOM 1753 C GLY B 106 -23.920 15.743 16.094 1.00 57.72 C ATOM 1754 O GLY B 106 -23.828 16.623 15.191 1.00 53.93 O ATOM 1755 H GLY B 106 -21.308 14.752 14.837 1.00 0.00 H ATOM 1756 N PRO B 107 -25.071 15.473 16.735 1.00 59.12 N ATOM 1757 CA PRO B 107 -26.301 16.123 16.315 1.00 62.94 C ATOM 1758 C PRO B 107 -26.324 17.645 16.493 1.00 61.48 C ATOM 1759 O PRO B 107 -27.000 18.302 15.741 1.00 63.55 O ATOM 1760 CB PRO B 107 -27.380 15.493 17.240 1.00 66.14 C ATOM 1761 CG PRO B 107 -26.801 14.185 17.651 1.00 67.26 C ATOM 1762 CD PRO B 107 -25.326 14.405 17.732 1.00 63.75 C ATOM 1763 N GLU B 108 -25.648 18.182 17.508 1.00 61.64 N ATOM 1764 CA GLU B 108 -25.668 19.623 17.782 1.00 62.20 C ATOM 1765 C GLU B 108 -24.775 20.388 16.793 1.00 60.56 C ATOM 1766 O GLU B 108 -24.679 21.592 16.875 1.00 61.89 O ATOM 1767 CB GLU B 108 -25.175 19.879 19.199 1.00 66.54 C ATOM 1768 H GLU B 108 -25.088 17.560 18.126 1.00 0.00 H ATOM 1769 N GLY B 109 -24.117 19.678 15.877 1.00 56.89 N ATOM 1770 CA GLY B 109 -23.270 20.300 14.857 1.00 52.90 C ATOM 1771 C GLY B 109 -21.918 20.701 15.368 1.00 51.17 C ATOM 1772 O GLY B 109 -21.610 20.449 16.513 1.00 47.53 O ATOM 1773 H GLY B 109 -24.209 18.642 15.887 1.00 0.00 H ATOM 1774 N CYS B 110 -21.083 21.282 14.485 1.00 46.82 N ATOM 1775 CA CYS B 110 -19.692 21.592 14.836 1.00 46.16 C ATOM 1776 C CYS B 110 -19.515 23.026 15.474 1.00 47.80 C ATOM 1777 O CYS B 110 -18.417 23.416 15.763 1.00 47.17 O ATOM 1778 CB CYS B 110 -18.834 21.518 13.570 1.00 43.69 C ATOM 1779 SG CYS B 110 -19.158 20.022 12.548 1.00 47.05 S ATOM 1780 H CYS B 110 -21.432 21.516 13.534 1.00 0.00 H ATOM 1781 N SER B 111 -20.576 23.797 15.588 1.00 47.85 N ATOM 1782 CA SER B 111 -20.533 25.205 16.060 1.00 52.03 C ATOM 1783 C SER B 111 -21.559 25.399 17.147 1.00 53.67 C ATOM 1784 O SER B 111 -22.229 26.446 17.231 1.00 57.15 O ATOM 1785 CB SER B 111 -20.764 26.214 14.910 1.00 53.23 C ATOM 1786 OG SER B 111 -19.746 26.002 13.937 1.00 54.82 O ATOM 1787 HG SER B 111 -19.870 26.637 13.187 1.00 0.00 H ATOM 1788 H SER B 111 -21.501 23.396 15.332 1.00 0.00 H ATOM 1789 N ALA B 112 -21.655 24.412 18.035 1.00 54.15 N ATOM 1790 CA ALA B 112 -22.608 24.486 19.127 1.00 61.35 C ATOM 1791 C ALA B 112 -22.161 25.574 20.142 1.00 65.03 C ATOM 1792 O ALA B 112 -20.974 25.786 20.350 1.00 64.92 O ATOM 1793 CB ALA B 112 -22.734 23.102 19.799 1.00 61.38 C ATOM 1794 H ALA B 112 -21.040 23.578 17.945 1.00 0.00 H ATOM 1795 N TRP B 113 -23.098 26.272 20.747 1.00 71.43 N ATOM 1796 CA TRP B 113 -22.781 27.280 21.778 1.00 76.80 C ATOM 1797 C TRP B 113 -22.890 26.636 23.164 1.00 79.72 C ATOM 1798 O TRP B 113 -23.408 25.538 23.287 1.00 83.13 O ATOM 1799 CB TRP B 113 -23.723 28.489 21.660 1.00 79.24 C ATOM 1800 CG TRP B 113 -23.509 29.306 20.415 1.00 79.26 C ATOM 1801 CD1 TRP B 113 -24.160 29.169 19.223 1.00 78.43 C ATOM 1802 CD2 TRP B 113 -22.569 30.381 20.238 1.00 82.23 C ATOM 1803 NE1 TRP B 113 -23.693 30.092 18.318 1.00 80.25 N ATOM 1804 CE2 TRP B 113 -22.715 30.848 18.910 1.00 83.78 C ATOM 1805 CE3 TRP B 113 -21.625 31.003 21.074 1.00 81.72 C ATOM 1806 CZ2 TRP B 113 -21.942 31.906 18.395 1.00 82.77 C ATOM 1807 CZ3 TRP B 113 -20.855 32.045 20.555 1.00 82.33 C ATOM 1808 CH2 TRP B 113 -21.025 32.490 19.236 1.00 81.20 C ATOM 1809 HE1 TRP B 113 -24.028 30.200 17.339 1.00 0.00 H ATOM 1810 H TRP B 113 -24.093 26.109 20.491 1.00 0.00 H ATOM 1811 N SER B 114 -22.398 27.317 24.193 1.00 84.38 N ATOM 1812 CA SER B 114 -22.573 26.883 25.591 1.00 83.93 C ATOM 1813 C SER B 114 -23.998 27.150 26.048 1.00 90.62 C ATOM 1814 O SER B 114 -24.790 26.224 26.192 1.00 94.38 O ATOM 1815 CB SER B 114 -21.586 27.616 26.492 1.00 83.89 C ATOM 1816 OG SER B 114 -22.032 28.949 26.738 1.00 90.99 O ATOM 1817 HG SER B 114 -21.381 29.411 27.324 1.00 0.00 H ATOM 1818 H SER B 114 -21.868 28.192 24.005 1.00 0.00 H TER 1819 SER B 114 ATOM 1820 N ALA C 2 7.512 12.951 15.888 1.00 40.69 N ATOM 1821 CA ALA C 2 7.044 13.319 14.534 1.00 40.80 C ATOM 1822 C ALA C 2 8.123 14.257 14.004 1.00 42.34 C ATOM 1823 O ALA C 2 8.803 14.890 14.820 1.00 40.75 O ATOM 1824 CB ALA C 2 5.721 14.034 14.596 1.00 41.73 C ATOM 1825 HN3 ALA C 2 7.601 13.810 16.468 1.00 0.00 H ATOM 1826 HN2 ALA C 2 8.437 12.481 15.818 1.00 0.00 H ATOM 1827 HN1 ALA C 2 6.826 12.305 16.327 1.00 0.00 H ATOM 1828 N LYS C 3 8.324 14.242 12.694 1.00 36.04 N ATOM 1829 CA LYS C 3 9.240 15.121 12.011 1.00 38.32 C ATOM 1830 C LYS C 3 8.439 16.199 11.274 1.00 35.28 C ATOM 1831 O LYS C 3 7.505 15.878 10.514 1.00 32.15 O ATOM 1832 CB LYS C 3 10.118 14.317 11.076 1.00 41.66 C ATOM 1833 CG LYS C 3 11.105 15.092 10.264 1.00 47.10 C ATOM 1834 CD LYS C 3 12.150 14.192 9.648 1.00 53.19 C ATOM 1835 CE LYS C 3 12.912 15.004 8.604 1.00 58.40 C ATOM 1836 NZ LYS C 3 13.964 14.253 7.879 1.00 63.96 N ATOM 1837 HZ1 LYS C 3 14.668 13.902 8.559 1.00 0.00 H ATOM 1838 HZ2 LYS C 3 13.532 13.450 7.379 1.00 0.00 H ATOM 1839 HZ3 LYS C 3 14.427 14.882 7.193 1.00 0.00 H ATOM 1840 H LYS C 3 7.789 13.555 12.125 1.00 0.00 H ATOM 1841 N PRO C 4 8.762 17.483 11.506 1.00 37.24 N ATOM 1842 CA PRO C 4 8.167 18.577 10.721 1.00 37.24 C ATOM 1843 C PRO C 4 8.403 18.442 9.291 1.00 35.72 C ATOM 1844 O PRO C 4 9.479 18.019 8.825 1.00 36.04 O ATOM 1845 CB PRO C 4 8.864 19.880 11.279 1.00 40.32 C ATOM 1846 CG PRO C 4 9.380 19.486 12.593 1.00 45.50 C ATOM 1847 CD PRO C 4 9.684 18.014 12.546 1.00 43.25 C ATOM 1848 N ALA C 5 7.359 18.742 8.524 1.00 33.47 N ATOM 1849 CA ALA C 5 7.391 18.622 7.110 1.00 33.00 C ATOM 1850 C ALA C 5 6.606 19.754 6.458 1.00 32.07 C ATOM 1851 O ALA C 5 5.804 20.405 7.106 1.00 34.61 O ATOM 1852 CB ALA C 5 6.832 17.260 6.659 1.00 33.14 C ATOM 1853 H ALA C 5 6.485 19.077 8.978 1.00 0.00 H ATOM 1854 N ASN C 6 6.890 20.026 5.181 1.00 30.47 N ATOM 1855 CA ASN C 6 6.169 20.945 4.419 1.00 31.14 C ATOM 1856 C ASN C 6 5.490 20.052 3.350 1.00 30.54 C ATOM 1857 O ASN C 6 6.156 19.233 2.781 1.00 32.62 O ATOM 1858 CB ASN C 6 7.107 21.922 3.749 1.00 35.41 C ATOM 1859 CG ASN C 6 7.747 22.857 4.752 1.00 40.84 C ATOM 1860 OD1 ASN C 6 7.231 23.896 4.994 1.00 46.65 O ATOM 1861 ND2 ASN C 6 8.756 22.411 5.402 1.00 43.01 N ATOM 1862 HD22 ASN C 6 9.172 21.492 5.150 1.00 0.00 H ATOM 1863 HD21 ASN C 6 9.159 22.968 6.182 1.00 0.00 H ATOM 1864 H ASN C 6 7.687 19.529 4.734 1.00 0.00 H ATOM 1865 N LYS C 7 4.211 20.214 3.145 1.00 27.65 N ATOM 1866 CA LYS C 7 3.489 19.451 2.101 1.00 27.48 C ATOM 1867 C LYS C 7 3.248 20.410 0.973 1.00 26.53 C ATOM 1868 O LYS C 7 2.421 21.347 1.079 1.00 28.73 O ATOM 1869 CB LYS C 7 2.196 18.858 2.635 1.00 30.90 C ATOM 1870 CG LYS C 7 1.271 18.195 1.613 1.00 34.57 C ATOM 1871 CD LYS C 7 -0.049 17.852 2.297 1.00 40.62 C ATOM 1872 CE LYS C 7 -1.200 17.606 1.357 1.00 48.03 C ATOM 1873 NZ LYS C 7 -2.159 16.622 1.966 1.00 53.84 N ATOM 1874 HZ1 LYS C 7 -1.665 15.725 2.146 1.00 0.00 H ATOM 1875 HZ2 LYS C 7 -2.524 17.004 2.862 1.00 0.00 H ATOM 1876 HZ3 LYS C 7 -2.949 16.459 1.310 1.00 0.00 H ATOM 1877 H LYS C 7 3.686 20.896 3.729 1.00 0.00 H ATOM 1878 N LEU C 8 4.031 20.223 -0.075 1.00 26.13 N ATOM 1879 CA LEU C 8 3.952 21.028 -1.290 1.00 25.01 C ATOM 1880 C LEU C 8 2.951 20.383 -2.218 1.00 25.01 C ATOM 1881 O LEU C 8 3.033 19.148 -2.442 1.00 25.47 O ATOM 1882 CB LEU C 8 5.310 21.087 -1.947 1.00 26.77 C ATOM 1883 CG LEU C 8 5.328 21.961 -3.188 1.00 27.34 C ATOM 1884 CD1 LEU C 8 5.259 23.433 -2.779 1.00 31.63 C ATOM 1885 CD2 LEU C 8 6.617 21.728 -3.970 1.00 29.52 C ATOM 1886 H LEU C 8 4.740 19.463 -0.032 1.00 0.00 H ATOM 1887 N VAL C 9 2.003 21.161 -2.709 1.00 26.07 N ATOM 1888 CA VAL C 9 0.984 20.628 -3.618 1.00 25.89 C ATOM 1889 C VAL C 9 1.075 21.446 -4.904 1.00 25.25 C ATOM 1890 O VAL C 9 1.095 22.668 -4.880 1.00 26.02 O ATOM 1891 CB VAL C 9 -0.402 20.796 -3.020 1.00 25.61 C ATOM 1892 CG1 VAL C 9 -1.486 20.323 -3.974 1.00 26.95 C ATOM 1893 CG2 VAL C 9 -0.509 20.151 -1.635 1.00 27.18 C ATOM 1894 H VAL C 9 1.979 22.167 -2.447 1.00 0.00 H ATOM 1895 N ILE C 10 1.006 20.720 -6.014 1.00 23.55 N ATOM 1896 CA ILE C 10 1.088 21.304 -7.372 1.00 24.43 C ATOM 1897 C ILE C 10 -0.137 20.743 -8.084 1.00 27.63 C ATOM 1898 O ILE C 10 -0.209 19.524 -8.232 1.00 27.26 O ATOM 1899 CB ILE C 10 2.332 20.903 -8.079 1.00 26.93 C ATOM 1900 CG1 ILE C 10 3.604 21.335 -7.331 1.00 26.43 C ATOM 1901 CG2 ILE C 10 2.319 21.468 -9.499 1.00 29.32 C ATOM 1902 CD1 ILE C 10 4.901 20.731 -7.867 1.00 30.10 C ATOM 1903 H ILE C 10 0.889 19.691 -5.925 1.00 0.00 H ATOM 1904 N VAL C 11 -1.055 21.584 -8.590 1.00 27.74 N ATOM 1905 CA VAL C 11 -2.189 21.098 -9.391 1.00 29.06 C ATOM 1906 C VAL C 11 -1.979 21.739 -10.760 1.00 29.37 C ATOM 1907 O VAL C 11 -1.816 22.990 -10.879 1.00 28.54 O ATOM 1908 CB VAL C 11 -3.557 21.499 -8.771 1.00 26.47 C ATOM 1909 CG1 VAL C 11 -4.703 20.814 -9.509 1.00 28.57 C ATOM 1910 CG2 VAL C 11 -3.647 21.107 -7.320 1.00 27.57 C ATOM 1911 H VAL C 11 -0.961 22.604 -8.411 1.00 0.00 H ATOM 1912 N THR C 12 -1.970 20.919 -11.802 1.00 28.10 N ATOM 1913 CA THR C 12 -1.640 21.464 -13.102 1.00 30.87 C ATOM 1914 C THR C 12 -2.133 20.555 -14.173 1.00 30.27 C ATOM 1915 O THR C 12 -2.838 19.581 -13.904 1.00 28.52 O ATOM 1916 CB THR C 12 -0.096 21.666 -13.175 1.00 33.86 C ATOM 1917 OG1 THR C 12 0.257 22.430 -14.322 1.00 33.72 O ATOM 1918 CG2 THR C 12 0.659 20.377 -13.175 1.00 35.45 C ATOM 1919 HG1 THR C 12 -0.181 23.317 -14.274 1.00 0.00 H ATOM 1920 H THR C 12 -2.194 19.910 -11.688 1.00 0.00 H ATOM 1921 N GLU C 13 -1.762 20.893 -15.385 1.00 29.92 N ATOM 1922 CA GLU C 13 -2.190 20.129 -16.526 1.00 32.33 C ATOM 1923 C GLU C 13 -1.514 18.769 -16.563 1.00 32.85 C ATOM 1924 O GLU C 13 -0.301 18.632 -16.394 1.00 32.45 O ATOM 1925 CB GLU C 13 -1.892 20.904 -17.832 1.00 32.96 C ATOM 1926 CG GLU C 13 -2.482 22.276 -17.857 1.00 33.70 C ATOM 1927 CD GLU C 13 -2.228 23.004 -19.167 1.00 37.81 C ATOM 1928 OE1 GLU C 13 -2.104 22.331 -20.261 1.00 38.62 O ATOM 1929 OE2 GLU C 13 -2.191 24.261 -19.098 1.00 37.63 O ATOM 1930 H GLU C 13 -1.151 21.723 -15.523 1.00 0.00 H ATOM 1931 N LYS C 14 -2.313 17.752 -16.871 1.00 35.00 N ATOM 1932 CA LYS C 14 -1.839 16.361 -16.881 1.00 38.62 C ATOM 1933 C LYS C 14 -0.657 16.142 -17.838 1.00 35.92 C ATOM 1934 O LYS C 14 0.177 15.319 -17.606 1.00 34.24 O ATOM 1935 CB LYS C 14 -3.038 15.481 -17.307 1.00 43.24 C ATOM 1936 CG LYS C 14 -2.847 13.997 -17.423 1.00 55.40 C ATOM 1937 CD LYS C 14 -4.137 13.328 -17.985 1.00 64.53 C ATOM 1938 CE LYS C 14 -4.988 12.576 -16.947 1.00 72.33 C ATOM 1939 NZ LYS C 14 -5.384 13.355 -15.719 1.00 69.33 N ATOM 1940 HZ1 LYS C 14 -4.528 13.667 -15.217 1.00 0.00 H ATOM 1941 HZ2 LYS C 14 -5.943 14.185 -16.002 1.00 0.00 H ATOM 1942 HZ3 LYS C 14 -5.953 12.749 -15.094 1.00 0.00 H ATOM 1943 H LYS C 14 -3.306 17.947 -17.113 1.00 0.00 H ATOM 1944 N ILE C 15 -0.611 16.870 -18.948 1.00 35.79 N ATOM 1945 CA ILE C 15 0.513 16.778 -19.864 1.00 38.32 C ATOM 1946 C ILE C 15 1.868 17.101 -19.278 1.00 36.38 C ATOM 1947 O ILE C 15 2.870 16.701 -19.873 1.00 37.14 O ATOM 1948 CB ILE C 15 0.308 17.626 -21.134 1.00 42.89 C ATOM 1949 CG1 ILE C 15 0.059 19.115 -20.812 1.00 43.33 C ATOM 1950 CG2 ILE C 15 -0.763 16.979 -22.038 1.00 50.89 C ATOM 1951 CD1 ILE C 15 -0.214 19.977 -22.049 1.00 50.34 C ATOM 1952 H ILE C 15 -1.395 17.518 -19.166 1.00 0.00 H ATOM 1953 N LEU C 16 1.929 17.751 -18.102 1.00 33.15 N ATOM 1954 CA LEU C 16 3.216 18.085 -17.496 1.00 33.41 C ATOM 1955 C LEU C 16 3.697 17.017 -16.484 1.00 34.67 C ATOM 1956 O LEU C 16 4.703 17.215 -15.801 1.00 35.56 O ATOM 1957 CB LEU C 16 3.090 19.415 -16.779 1.00 32.99 C ATOM 1958 CG LEU C 16 2.777 20.639 -17.643 1.00 35.50 C ATOM 1959 CD1 LEU C 16 2.726 21.898 -16.802 1.00 34.00 C ATOM 1960 CD2 LEU C 16 3.799 20.820 -18.760 1.00 40.24 C ATOM 1961 H LEU C 16 1.049 18.019 -17.618 1.00 0.00 H ATOM 1962 N LEU C 17 2.993 15.895 -16.400 1.00 32.64 N ATOM 1963 CA LEU C 17 3.312 14.894 -15.367 1.00 34.83 C ATOM 1964 C LEU C 17 4.795 14.493 -15.381 1.00 34.45 C ATOM 1965 O LEU C 17 5.453 14.681 -14.361 1.00 33.47 O ATOM 1966 CB LEU C 17 2.399 13.673 -15.490 1.00 39.58 C ATOM 1967 CG LEU C 17 2.360 12.893 -14.153 1.00 39.53 C ATOM 1968 CD1 LEU C 17 1.062 12.101 -14.058 1.00 47.96 C ATOM 1969 CD2 LEU C 17 3.611 12.037 -14.083 1.00 43.64 C ATOM 1970 H LEU C 17 2.213 15.722 -17.066 1.00 0.00 H ATOM 1971 N LYS C 18 5.328 14.079 -16.551 1.00 35.17 N ATOM 1972 CA LYS C 18 6.718 13.575 -16.608 1.00 39.93 C ATOM 1973 C LYS C 18 7.691 14.720 -16.342 1.00 39.05 C ATOM 1974 O LYS C 18 8.709 14.560 -15.665 1.00 39.04 O ATOM 1975 CB LYS C 18 7.045 12.902 -17.937 1.00 42.21 C ATOM 1976 CG LYS C 18 6.593 11.450 -18.005 1.00 46.98 C ATOM 1977 CD LYS C 18 7.011 10.761 -19.286 1.00 50.35 C ATOM 1978 H LYS C 18 4.757 14.115 -17.419 1.00 0.00 H ATOM 1979 N LYS C 19 7.350 15.869 -16.891 1.00 38.30 N ATOM 1980 CA LYS C 19 8.205 17.076 -16.755 1.00 37.28 C ATOM 1981 C LYS C 19 8.358 17.494 -15.296 1.00 37.22 C ATOM 1982 O LYS C 19 9.465 17.822 -14.841 1.00 39.35 O ATOM 1983 CB LYS C 19 7.668 18.191 -17.633 1.00 37.62 C ATOM 1984 CG LYS C 19 7.986 17.956 -19.100 1.00 39.60 C ATOM 1985 CD LYS C 19 7.185 18.900 -20.021 1.00 42.10 C ATOM 1986 CE LYS C 19 7.522 18.677 -21.481 1.00 44.10 C ATOM 1987 NZ LYS C 19 6.641 19.534 -22.355 1.00 43.88 N ATOM 1988 HZ1 LYS C 19 5.645 19.283 -22.193 1.00 0.00 H ATOM 1989 HZ2 LYS C 19 6.791 20.536 -22.119 1.00 0.00 H ATOM 1990 HZ3 LYS C 19 6.882 19.372 -23.354 1.00 0.00 H ATOM 1991 H LYS C 19 6.463 15.932 -17.431 1.00 0.00 H ATOM 1992 N ILE C 20 7.265 17.485 -14.549 1.00 31.13 N ATOM 1993 CA ILE C 20 7.264 17.852 -13.175 1.00 34.59 C ATOM 1994 C ILE C 20 7.868 16.769 -12.272 1.00 35.57 C ATOM 1995 O ILE C 20 8.630 17.090 -11.362 1.00 33.09 O ATOM 1996 CB ILE C 20 5.871 18.328 -12.739 1.00 31.20 C ATOM 1997 CG1 ILE C 20 5.588 19.662 -13.403 1.00 33.93 C ATOM 1998 CG2 ILE C 20 5.839 18.519 -11.253 1.00 31.64 C ATOM 1999 CD1 ILE C 20 4.186 20.139 -13.212 1.00 33.63 C ATOM 2000 H ILE C 20 6.367 17.197 -14.987 1.00 0.00 H ATOM 2001 N ALA C 21 7.635 15.517 -12.613 1.00 34.16 N ATOM 2002 CA ALA C 21 8.199 14.416 -11.834 1.00 34.70 C ATOM 2003 C ALA C 21 9.709 14.490 -11.926 1.00 37.78 C ATOM 2004 O ALA C 21 10.393 14.152 -11.002 1.00 37.60 O ATOM 2005 CB ALA C 21 7.747 13.092 -12.364 1.00 33.82 C ATOM 2006 H ALA C 21 7.045 15.311 -13.444 1.00 0.00 H ATOM 2007 N LYS C 22 10.227 14.854 -13.094 1.00 36.67 N ATOM 2008 CA LYS C 22 11.662 14.929 -13.285 1.00 40.36 C ATOM 2009 C LYS C 22 12.272 15.996 -12.381 1.00 36.85 C ATOM 2010 O LYS C 22 13.336 15.763 -11.792 1.00 38.40 O ATOM 2011 CB LYS C 22 11.998 15.230 -14.772 1.00 42.82 C ATOM 2012 CG LYS C 22 13.494 15.306 -15.052 1.00 50.77 C ATOM 2013 CD LYS C 22 13.690 15.591 -16.531 1.00 55.14 C ATOM 2014 CE LYS C 22 15.058 15.132 -16.986 1.00 64.90 C ATOM 2015 NZ LYS C 22 16.118 15.986 -16.408 1.00 66.73 N ATOM 2016 HZ1 LYS C 22 15.975 16.969 -16.714 1.00 0.00 H ATOM 2017 HZ2 LYS C 22 16.075 15.935 -15.370 1.00 0.00 H ATOM 2018 HZ3 LYS C 22 17.047 15.652 -16.734 1.00 0.00 H ATOM 2019 H LYS C 22 9.593 15.089 -13.884 1.00 0.00 H ATOM 2020 N ILE C 23 11.631 17.153 -12.300 1.00 36.72 N ATOM 2021 CA ILE C 23 12.086 18.191 -11.357 1.00 36.56 C ATOM 2022 C ILE C 23 12.059 17.697 -9.910 1.00 35.68 C ATOM 2023 O ILE C 23 13.016 17.910 -9.141 1.00 37.16 O ATOM 2024 CB ILE C 23 11.236 19.459 -11.517 1.00 35.84 C ATOM 2025 CG1 ILE C 23 11.594 20.084 -12.871 1.00 37.35 C ATOM 2026 CG2 ILE C 23 11.509 20.434 -10.400 1.00 37.77 C ATOM 2027 CD1 ILE C 23 10.582 21.131 -13.293 1.00 38.74 C ATOM 2028 H ILE C 23 10.803 17.330 -12.904 1.00 0.00 H ATOM 2029 N ILE C 24 10.977 17.015 -9.527 1.00 33.22 N ATOM 2030 CA ILE C 24 10.892 16.482 -8.168 1.00 31.21 C ATOM 2031 C ILE C 24 11.974 15.494 -7.936 1.00 36.83 C ATOM 2032 O ILE C 24 12.650 15.536 -6.900 1.00 38.29 O ATOM 2033 CB ILE C 24 9.480 15.875 -7.850 1.00 30.50 C ATOM 2034 CG1 ILE C 24 8.380 16.922 -7.972 1.00 32.26 C ATOM 2035 CG2 ILE C 24 9.406 15.343 -6.409 1.00 32.66 C ATOM 2036 CD1 ILE C 24 6.994 16.309 -8.103 1.00 31.57 C ATOM 2037 H ILE C 24 10.195 16.863 -10.195 1.00 0.00 H ATOM 2038 N ASP C 25 12.196 14.614 -8.893 1.00 37.39 N ATOM 2039 CA ASP C 25 13.249 13.620 -8.778 1.00 42.02 C ATOM 2040 C ASP C 25 14.670 14.237 -8.591 1.00 46.15 C ATOM 2041 O ASP C 25 15.496 13.672 -7.871 1.00 47.98 O ATOM 2042 CB ASP C 25 13.223 12.691 -9.994 1.00 42.93 C ATOM 2043 CG ASP C 25 12.090 11.630 -9.945 1.00 46.03 C ATOM 2044 OD1 ASP C 25 11.524 11.355 -8.868 1.00 46.33 O ATOM 2045 OD2 ASP C 25 11.799 11.054 -11.005 1.00 49.21 O ATOM 2046 H ASP C 25 11.605 14.632 -9.748 1.00 0.00 H ATOM 2047 N GLU C 26 14.927 15.359 -9.271 1.00 44.03 N ATOM 2048 CA GLU C 26 16.208 16.096 -9.170 1.00 48.96 C ATOM 2049 C GLU C 26 16.387 16.907 -7.896 1.00 45.52 C ATOM 2050 O GLU C 26 17.521 17.171 -7.486 1.00 47.96 O ATOM 2051 CB GLU C 26 16.360 17.014 -10.374 1.00 51.21 C ATOM 2052 CG GLU C 26 16.563 16.204 -11.629 1.00 57.64 C ATOM 2053 CD GLU C 26 16.486 17.006 -12.912 1.00 60.61 C ATOM 2054 OE1 GLU C 26 16.059 18.186 -12.904 1.00 65.92 O ATOM 2055 OE2 GLU C 26 16.847 16.416 -13.941 1.00 64.94 O ATOM 2056 H GLU C 26 14.190 15.733 -9.903 1.00 0.00 H ATOM 2057 N SER C 27 15.287 17.240 -7.242 1.00 42.74 N ATOM 2058 CA SER C 27 15.253 18.158 -6.110 1.00 42.55 C ATOM 2059 C SER C 27 15.862 17.632 -4.827 1.00 48.71 C ATOM 2060 O SER C 27 16.219 18.398 -3.906 1.00 53.42 O ATOM 2061 CB SER C 27 13.807 18.516 -5.811 1.00 39.92 C ATOM 2062 OG SER C 27 13.157 17.426 -5.201 1.00 38.10 O ATOM 2063 HG SER C 27 13.181 16.646 -5.810 1.00 0.00 H ATOM 2064 H SER C 27 14.389 16.820 -7.555 1.00 0.00 H ATOM 2065 N GLY C 28 15.962 16.335 -4.706 1.00 44.10 N ATOM 2066 CA GLY C 28 16.282 15.834 -3.398 1.00 44.79 C ATOM 2067 C GLY C 28 15.098 15.371 -2.591 1.00 42.33 C ATOM 2068 O GLY C 28 15.303 14.658 -1.616 1.00 42.73 O ATOM 2069 H GLY C 28 15.817 15.698 -5.515 1.00 0.00 H ATOM 2070 N ALA C 29 13.856 15.721 -2.964 1.00 39.16 N ATOM 2071 CA ALA C 29 12.679 15.185 -2.262 1.00 40.01 C ATOM 2072 C ALA C 29 12.760 13.652 -2.302 1.00 37.05 C ATOM 2073 O ALA C 29 13.288 13.086 -3.259 1.00 37.92 O ATOM 2074 CB ALA C 29 11.405 15.630 -2.909 1.00 36.33 C ATOM 2075 H ALA C 29 13.725 16.379 -3.759 1.00 0.00 H ATOM 2076 N LYS C 30 12.231 13.004 -1.296 1.00 33.09 N ATOM 2077 CA LYS C 30 12.405 11.577 -1.134 1.00 36.73 C ATOM 2078 C LYS C 30 11.293 10.771 -1.804 1.00 38.92 C ATOM 2079 O LYS C 30 11.383 9.551 -1.839 1.00 40.79 O ATOM 2080 CB LYS C 30 12.413 11.190 0.338 1.00 41.67 C ATOM 2081 CG LYS C 30 13.387 12.008 1.204 1.00 45.15 C ATOM 2082 CD LYS C 30 14.778 11.737 0.839 1.00 49.72 C ATOM 2083 CE LYS C 30 15.691 12.371 1.894 1.00 52.77 C ATOM 2084 NZ LYS C 30 16.969 11.782 1.588 1.00 57.52 N ATOM 2085 HZ1 LYS C 30 16.903 10.748 1.677 1.00 0.00 H ATOM 2086 HZ2 LYS C 30 17.240 12.031 0.615 1.00 0.00 H ATOM 2087 HZ3 LYS C 30 17.684 12.144 2.251 1.00 0.00 H ATOM 2088 H LYS C 30 11.671 13.529 -0.594 1.00 0.00 H ATOM 2089 N GLY C 31 10.261 11.458 -2.261 1.00 37.35 N ATOM 2090 CA GLY C 31 9.117 10.776 -2.953 1.00 36.60 C ATOM 2091 C GLY C 31 8.101 11.801 -3.338 1.00 33.17 C ATOM 2092 O GLY C 31 8.241 13.009 -3.083 1.00 30.57 O ATOM 2093 H GLY C 31 10.241 12.491 -2.139 1.00 0.00 H ATOM 2094 N TYR C 32 6.998 11.326 -3.918 1.00 28.26 N ATOM 2095 CA TYR C 32 5.918 12.182 -4.262 1.00 25.55 C ATOM 2096 C TYR C 32 4.679 11.264 -4.464 1.00 25.79 C ATOM 2097 O TYR C 32 4.880 10.080 -4.724 1.00 26.82 O ATOM 2098 CB TYR C 32 6.161 13.098 -5.480 1.00 28.04 C ATOM 2099 CG TYR C 32 6.357 12.402 -6.805 1.00 29.55 C ATOM 2100 CD1 TYR C 32 5.265 11.901 -7.513 1.00 33.67 C ATOM 2101 CD2 TYR C 32 7.627 12.174 -7.312 1.00 34.36 C ATOM 2102 CE1 TYR C 32 5.444 11.164 -8.693 1.00 32.56 C ATOM 2103 CE2 TYR C 32 7.809 11.504 -8.530 1.00 34.65 C ATOM 2104 CZ TYR C 32 6.722 11.013 -9.195 1.00 37.62 C ATOM 2105 OH TYR C 32 6.963 10.340 -10.396 1.00 39.13 O ATOM 2106 HH TYR C 32 7.546 9.558 -10.224 1.00 0.00 H ATOM 2107 H TYR C 32 6.927 10.309 -4.122 1.00 0.00 H ATOM 2108 N THR C 33 3.502 11.849 -4.297 1.00 25.13 N ATOM 2109 CA THR C 33 2.275 11.188 -4.684 1.00 27.08 C ATOM 2110 C THR C 33 1.689 12.002 -5.828 1.00 27.22 C ATOM 2111 O THR C 33 1.844 13.212 -5.882 1.00 27.67 O ATOM 2112 CB THR C 33 1.358 11.159 -3.445 1.00 30.10 C ATOM 2113 OG1 THR C 33 2.024 10.280 -2.502 1.00 33.39 O ATOM 2114 CG2 THR C 33 0.095 10.515 -3.713 1.00 38.22 C ATOM 2115 HG1 THR C 33 1.484 10.215 -1.675 1.00 0.00 H ATOM 2116 H THR C 33 3.460 12.801 -3.880 1.00 0.00 H ATOM 2117 N VAL C 34 1.028 11.350 -6.781 1.00 27.37 N ATOM 2118 CA VAL C 34 0.413 12.120 -7.844 1.00 29.32 C ATOM 2119 C VAL C 34 -0.941 11.455 -8.097 1.00 31.46 C ATOM 2120 O VAL C 34 -1.092 10.241 -7.954 1.00 33.01 O ATOM 2121 CB VAL C 34 1.304 12.211 -9.102 1.00 31.34 C ATOM 2122 CG1 VAL C 34 1.598 10.850 -9.652 1.00 33.98 C ATOM 2123 CG2 VAL C 34 0.709 13.159 -10.142 1.00 35.87 C ATOM 2124 H VAL C 34 0.954 10.313 -6.764 1.00 0.00 H ATOM 2125 N MET C 35 -1.948 12.236 -8.504 1.00 29.36 N ATOM 2126 CA MET C 35 -3.263 11.674 -8.695 1.00 32.77 C ATOM 2127 C MET C 35 -3.963 12.439 -9.772 1.00 32.17 C ATOM 2128 O MET C 35 -3.668 13.605 -9.952 1.00 27.62 O ATOM 2129 CB MET C 35 -4.034 11.694 -7.351 1.00 36.11 C ATOM 2130 CG MET C 35 -4.308 13.076 -6.754 1.00 37.01 C ATOM 2131 SD MET C 35 -4.408 13.060 -4.938 1.00 46.84 S ATOM 2132 CE MET C 35 -2.640 13.304 -4.622 1.00 42.97 C ATOM 2133 H MET C 35 -1.783 13.247 -8.683 1.00 0.00 H ATOM 2134 N ASN C 36 -4.879 11.765 -10.456 1.00 32.34 N ATOM 2135 CA ASN C 36 -5.698 12.390 -11.471 1.00 35.68 C ATOM 2136 C ASN C 36 -6.811 13.198 -10.798 1.00 33.79 C ATOM 2137 O ASN C 36 -7.400 12.717 -9.871 1.00 37.71 O ATOM 2138 CB ASN C 36 -6.343 11.302 -12.323 1.00 40.58 C ATOM 2139 CG ASN C 36 -5.344 10.645 -13.218 1.00 44.09 C ATOM 2140 OD1 ASN C 36 -4.468 11.285 -13.806 1.00 44.49 O ATOM 2141 ND2 ASN C 36 -5.423 9.351 -13.261 1.00 51.11 N ATOM 2142 HD22 ASN C 36 -6.182 8.859 -12.747 1.00 0.00 H ATOM 2143 HD21 ASN C 36 -4.728 8.806 -13.809 1.00 0.00 H ATOM 2144 H ASN C 36 -5.012 10.753 -10.255 1.00 0.00 H ATOM 2145 N THR C 37 -7.003 14.448 -11.237 1.00 33.55 N ATOM 2146 CA THR C 37 -8.034 15.284 -10.676 1.00 33.01 C ATOM 2147 C THR C 37 -8.739 16.043 -11.750 1.00 35.61 C ATOM 2148 O THR C 37 -8.323 16.048 -12.908 1.00 41.45 O ATOM 2149 CB THR C 37 -7.379 16.308 -9.680 1.00 32.87 C ATOM 2150 OG1 THR C 37 -6.355 17.063 -10.354 1.00 33.31 O ATOM 2151 CG2 THR C 37 -6.737 15.600 -8.538 1.00 35.19 C ATOM 2152 HG1 THR C 37 -6.756 17.556 -11.113 1.00 0.00 H ATOM 2153 H THR C 37 -6.398 14.822 -11.996 1.00 0.00 H ATOM 2154 N GLY C 38 -9.823 16.697 -11.381 1.00 36.92 N ATOM 2155 CA GLY C 38 -10.512 17.596 -12.278 1.00 40.05 C ATOM 2156 C GLY C 38 -10.377 19.003 -11.738 1.00 43.38 C ATOM 2157 O GLY C 38 -10.079 19.219 -10.564 1.00 39.33 O ATOM 2158 H GLY C 38 -10.192 16.562 -10.418 1.00 0.00 H ATOM 2159 N GLY C 39 -10.591 19.999 -12.547 1.00 46.49 N ATOM 2160 CA GLY C 39 -10.688 21.304 -11.952 1.00 50.05 C ATOM 2161 C GLY C 39 -11.028 22.393 -12.884 1.00 50.60 C ATOM 2162 O GLY C 39 -11.177 22.163 -14.084 1.00 49.00 O ATOM 2163 H GLY C 39 -10.687 19.858 -13.573 1.00 0.00 H ATOM 2164 N LYS C 40 -11.151 23.581 -12.326 1.00 47.36 N ATOM 2165 CA LYS C 40 -11.048 24.802 -13.150 1.00 52.07 C ATOM 2166 C LYS C 40 -10.362 25.910 -12.360 1.00 52.34 C ATOM 2167 O LYS C 40 -10.291 25.841 -11.098 1.00 43.85 O ATOM 2168 CB LYS C 40 -12.414 25.225 -13.628 1.00 60.43 C ATOM 2169 CG LYS C 40 -13.448 25.213 -12.550 1.00 65.22 C ATOM 2170 CD LYS C 40 -14.508 26.256 -12.780 1.00 75.06 C ATOM 2171 CE LYS C 40 -14.063 27.609 -12.231 1.00 79.52 C ATOM 2172 NZ LYS C 40 -15.160 28.605 -12.395 1.00 82.42 N ATOM 2173 HZ1 LYS C 40 -15.391 28.702 -13.404 1.00 0.00 H ATOM 2174 HZ2 LYS C 40 -16.001 28.282 -11.875 1.00 0.00 H ATOM 2175 HZ3 LYS C 40 -14.851 29.524 -12.019 1.00 0.00 H ATOM 2176 H LYS C 40 -11.321 23.658 -11.303 1.00 0.00 H ATOM 2177 N GLY C 41 -9.836 26.933 -13.040 1.00 50.70 N ATOM 2178 CA GLY C 41 -9.167 28.029 -12.279 1.00 55.21 C ATOM 2179 C GLY C 41 -8.420 29.184 -12.930 1.00 64.61 C ATOM 2180 O GLY C 41 -7.791 29.969 -12.189 1.00 65.22 O ATOM 2181 H GLY C 41 -9.892 26.965 -14.078 1.00 0.00 H TER 2182 GLY C 41 ATOM 2183 N ILE C 56 -15.143 21.430 -16.040 1.00 80.06 N ATOM 2184 CA ILE C 56 -14.056 20.703 -15.365 1.00 77.05 C ATOM 2185 C ILE C 56 -13.116 20.147 -16.449 1.00 75.10 C ATOM 2186 O ILE C 56 -13.588 19.611 -17.439 1.00 81.46 O ATOM 2187 CB ILE C 56 -14.612 19.564 -14.442 1.00 80.83 C ATOM 2188 CG1 ILE C 56 -15.178 20.132 -13.122 1.00 83.18 C ATOM 2189 CG2 ILE C 56 -13.535 18.549 -14.069 1.00 73.59 C ATOM 2190 CD1 ILE C 56 -16.263 19.286 -12.485 1.00 84.96 C ATOM 2191 HN3 ILE C 56 -15.659 20.778 -16.665 1.00 0.00 H ATOM 2192 HN2 ILE C 56 -14.742 22.207 -16.603 1.00 0.00 H ATOM 2193 HN1 ILE C 56 -15.794 21.817 -15.328 1.00 0.00 H ATOM 2194 N GLU C 57 -11.803 20.314 -16.307 1.00 66.48 N ATOM 2195 CA GLU C 57 -10.857 19.555 -17.150 1.00 68.16 C ATOM 2196 C GLU C 57 -10.164 18.473 -16.301 1.00 60.90 C ATOM 2197 O GLU C 57 -10.076 18.635 -15.096 1.00 53.12 O ATOM 2198 CB GLU C 57 -9.852 20.483 -17.830 1.00 70.55 C ATOM 2199 CG GLU C 57 -10.159 20.677 -19.311 1.00 82.15 C ATOM 2200 CD GLU C 57 -9.960 22.104 -19.788 1.00 84.19 C ATOM 2201 OE1 GLU C 57 -9.063 22.796 -19.259 1.00 82.80 O ATOM 2202 OE2 GLU C 57 -10.708 22.525 -20.699 1.00 87.88 O ATOM 2203 H GLU C 57 -11.441 20.983 -15.598 1.00 0.00 H ATOM 2204 N ALA C 58 -9.748 17.360 -16.915 1.00 60.33 N ATOM 2205 CA ALA C 58 -8.945 16.317 -16.233 1.00 55.15 C ATOM 2206 C ALA C 58 -7.527 16.814 -16.129 1.00 50.50 C ATOM 2207 O ALA C 58 -6.953 17.141 -17.111 1.00 47.73 O ATOM 2208 CB ALA C 58 -8.975 15.000 -16.989 1.00 57.36 C ATOM 2209 H ALA C 58 -9.999 17.220 -17.915 1.00 0.00 H ATOM 2210 N ASN C 59 -6.983 16.891 -14.905 1.00 36.70 N ATOM 2211 CA ASN C 59 -5.653 17.381 -14.642 1.00 34.31 C ATOM 2212 C ASN C 59 -4.951 16.526 -13.611 1.00 32.37 C ATOM 2213 O ASN C 59 -5.394 15.424 -13.417 1.00 32.71 O ATOM 2214 CB ASN C 59 -5.647 18.818 -14.241 1.00 36.85 C ATOM 2215 CG ASN C 59 -6.635 19.167 -13.216 1.00 38.42 C ATOM 2216 OD1 ASN C 59 -7.054 18.310 -12.444 1.00 42.06 O ATOM 2217 ND2 ASN C 59 -7.086 20.471 -13.229 1.00 40.92 N ATOM 2218 HD22 ASN C 59 -6.690 21.151 -13.909 1.00 0.00 H ATOM 2219 HD21 ASN C 59 -7.821 20.774 -12.559 1.00 0.00 H ATOM 2220 H ASN C 59 -7.556 16.578 -14.096 1.00 0.00 H ATOM 2221 N ILE C 60 -3.869 17.012 -13.015 1.00 30.24 N ATOM 2222 CA ILE C 60 -3.127 16.251 -12.033 1.00 30.11 C ATOM 2223 C ILE C 60 -2.723 17.051 -10.822 1.00 29.07 C ATOM 2224 O ILE C 60 -2.510 18.276 -10.864 1.00 29.32 O ATOM 2225 CB ILE C 60 -1.889 15.593 -12.626 1.00 31.57 C ATOM 2226 CG1 ILE C 60 -0.924 16.626 -13.193 1.00 32.61 C ATOM 2227 CG2 ILE C 60 -2.367 14.471 -13.579 1.00 36.84 C ATOM 2228 CD1 ILE C 60 0.441 16.079 -13.624 1.00 36.22 C ATOM 2229 H ILE C 60 -3.545 17.969 -13.261 1.00 0.00 H ATOM 2230 N LYS C 61 -2.606 16.321 -9.722 1.00 26.21 N ATOM 2231 CA LYS C 61 -2.215 16.936 -8.448 1.00 26.11 C ATOM 2232 C LYS C 61 -1.030 16.115 -7.902 1.00 25.30 C ATOM 2233 O LYS C 61 -1.147 14.932 -7.728 1.00 26.33 O ATOM 2234 CB LYS C 61 -3.329 16.864 -7.464 1.00 26.48 C ATOM 2235 CG LYS C 61 -2.905 17.418 -6.084 1.00 29.58 C ATOM 2236 CD LYS C 61 -4.138 17.406 -5.211 1.00 34.93 C ATOM 2237 CE LYS C 61 -3.867 17.610 -3.760 1.00 47.07 C ATOM 2238 NZ LYS C 61 -5.017 17.042 -2.981 1.00 42.81 N ATOM 2239 HZ1 LYS C 61 -5.894 17.531 -3.253 1.00 0.00 H ATOM 2240 HZ2 LYS C 61 -5.107 16.027 -3.188 1.00 0.00 H ATOM 2241 HZ3 LYS C 61 -4.845 17.176 -1.964 1.00 0.00 H ATOM 2242 H LYS C 61 -2.794 15.299 -9.762 1.00 0.00 H ATOM 2243 N PHE C 62 0.069 16.799 -7.652 1.00 25.48 N ATOM 2244 CA PHE C 62 1.212 16.200 -6.937 1.00 26.22 C ATOM 2245 C PHE C 62 1.177 16.661 -5.489 1.00 26.92 C ATOM 2246 O PHE C 62 0.836 17.798 -5.175 1.00 25.83 O ATOM 2247 CB PHE C 62 2.569 16.665 -7.482 1.00 26.38 C ATOM 2248 CG PHE C 62 2.957 16.202 -8.844 1.00 27.25 C ATOM 2249 CD1 PHE C 62 2.557 16.911 -9.987 1.00 31.73 C ATOM 2250 CD2 PHE C 62 3.769 15.091 -9.003 1.00 28.34 C ATOM 2251 CE1 PHE C 62 2.980 16.468 -11.230 1.00 31.15 C ATOM 2252 CE2 PHE C 62 4.197 14.648 -10.242 1.00 33.01 C ATOM 2253 CZ PHE C 62 3.806 15.350 -11.358 1.00 32.61 C ATOM 2254 H PHE C 62 0.132 17.788 -7.967 1.00 0.00 H ATOM 2255 N GLU C 63 1.574 15.755 -4.601 1.00 25.71 N ATOM 2256 CA GLU C 63 1.893 16.155 -3.223 1.00 26.55 C ATOM 2257 C GLU C 63 3.269 15.663 -2.881 1.00 26.16 C ATOM 2258 O GLU C 63 3.556 14.501 -3.103 1.00 28.35 O ATOM 2259 CB GLU C 63 0.891 15.557 -2.236 1.00 27.99 C ATOM 2260 CG GLU C 63 -0.564 15.882 -2.525 1.00 35.56 C ATOM 2261 CD GLU C 63 -1.561 15.103 -1.637 1.00 43.24 C ATOM 2262 OE1 GLU C 63 -1.435 13.853 -1.453 1.00 44.09 O ATOM 2263 OE2 GLU C 63 -2.566 15.736 -1.240 1.00 49.96 O ATOM 2264 H GLU C 63 1.659 14.758 -4.883 1.00 0.00 H ATOM 2265 N ILE C 64 4.113 16.559 -2.318 1.00 24.08 N ATOM 2266 CA ILE C 64 5.479 16.281 -2.087 1.00 25.46 C ATOM 2267 C ILE C 64 5.727 16.728 -0.611 1.00 26.96 C ATOM 2268 O ILE C 64 5.578 17.917 -0.343 1.00 29.07 O ATOM 2269 CB ILE C 64 6.416 17.044 -2.988 1.00 26.95 C ATOM 2270 CG1 ILE C 64 6.082 16.865 -4.497 1.00 29.33 C ATOM 2271 CG2 ILE C 64 7.856 16.594 -2.751 1.00 30.52 C ATOM 2272 CD1 ILE C 64 5.321 18.012 -5.048 1.00 31.50 C ATOM 2273 H ILE C 64 3.741 17.491 -2.044 1.00 0.00 H ATOM 2274 N LEU C 65 6.075 15.801 0.246 1.00 27.29 N ATOM 2275 CA LEU C 65 6.507 16.144 1.631 1.00 28.71 C ATOM 2276 C LEU C 65 7.994 16.389 1.605 1.00 27.62 C ATOM 2277 O LEU C 65 8.768 15.503 1.193 1.00 28.04 O ATOM 2278 CB LEU C 65 6.213 15.031 2.615 1.00 30.48 C ATOM 2279 CG LEU C 65 4.742 14.961 3.017 1.00 34.03 C ATOM 2280 CD1 LEU C 65 4.439 13.623 3.643 1.00 38.34 C ATOM 2281 CD2 LEU C 65 4.345 16.088 3.979 1.00 32.44 C ATOM 2282 H LEU C 65 6.049 14.803 -0.046 1.00 0.00 H ATOM 2283 N THR C 66 8.420 17.561 2.145 1.00 30.45 N ATOM 2284 CA THR C 66 9.840 17.925 2.218 1.00 29.72 C ATOM 2285 C THR C 66 10.212 18.202 3.673 1.00 31.87 C ATOM 2286 O THR C 66 9.393 18.679 4.439 1.00 32.97 O ATOM 2287 CB THR C 66 10.255 19.146 1.357 1.00 30.25 C ATOM 2288 OG1 THR C 66 9.559 20.324 1.773 1.00 33.43 O ATOM 2289 CG2 THR C 66 9.887 18.851 -0.095 1.00 31.98 C ATOM 2290 HG1 THR C 66 9.773 20.515 2.721 1.00 0.00 H ATOM 2291 H THR C 66 7.713 18.225 2.521 1.00 0.00 H ATOM 2292 N GLU C 67 11.455 17.948 3.993 1.00 33.39 N ATOM 2293 CA GLU C 67 11.983 18.160 5.379 1.00 35.38 C ATOM 2294 C GLU C 67 12.119 19.692 5.636 1.00 39.23 C ATOM 2295 O GLU C 67 11.903 20.165 6.719 1.00 41.83 O ATOM 2296 CB GLU C 67 13.369 17.414 5.523 1.00 35.82 C ATOM 2297 H GLU C 67 12.098 17.587 3.260 1.00 0.00 H ATOM 2298 N THR C 68 12.448 20.469 4.624 1.00 35.69 N ATOM 2299 CA THR C 68 12.706 21.888 4.769 1.00 38.55 C ATOM 2300 C THR C 68 11.740 22.659 3.881 1.00 38.20 C ATOM 2301 O THR C 68 11.332 22.229 2.752 1.00 36.07 O ATOM 2302 CB THR C 68 14.153 22.242 4.364 1.00 41.98 C ATOM 2303 OG1 THR C 68 14.364 21.993 2.963 1.00 40.09 O ATOM 2304 CG2 THR C 68 15.176 21.438 5.143 1.00 45.96 C ATOM 2305 HG1 THR C 68 14.203 21.035 2.771 1.00 0.00 H ATOM 2306 H THR C 68 12.526 20.045 3.678 1.00 0.00 H ATOM 2307 N ARG C 69 11.367 23.822 4.363 1.00 36.38 N ATOM 2308 CA ARG C 69 10.645 24.789 3.540 1.00 37.67 C ATOM 2309 C ARG C 69 11.449 25.203 2.294 1.00 38.64 C ATOM 2310 O ARG C 69 10.868 25.363 1.222 1.00 34.71 O ATOM 2311 CB ARG C 69 10.256 25.971 4.395 1.00 42.00 C ATOM 2312 CG ARG C 69 9.588 27.128 3.712 1.00 46.37 C ATOM 2313 CD ARG C 69 8.182 26.872 3.319 1.00 46.91 C ATOM 2314 NE ARG C 69 7.613 28.141 2.813 1.00 53.64 N ATOM 2315 CZ ARG C 69 6.570 28.788 3.326 1.00 52.74 C ATOM 2316 NH1 ARG C 69 5.912 28.291 4.348 1.00 52.56 N ATOM 2317 NH2 ARG C 69 6.130 29.904 2.759 1.00 48.03 N ATOM 2318 HE ARG C 69 8.070 28.565 1.981 1.00 0.00 H ATOM 2319 HH12 ARG C 69 5.098 28.805 4.742 1.00 0.00 H ATOM 2320 HH11 ARG C 69 6.205 27.384 4.764 1.00 0.00 H ATOM 2321 HH22 ARG C 69 5.314 30.406 3.164 1.00 0.00 H ATOM 2322 HH21 ARG C 69 6.601 30.276 1.910 1.00 0.00 H ATOM 2323 H ARG C 69 11.590 24.059 5.351 1.00 0.00 H ATOM 2324 N GLU C 70 12.775 25.354 2.457 1.00 39.21 N ATOM 2325 CA GLU C 70 13.646 25.744 1.353 1.00 41.84 C ATOM 2326 C GLU C 70 13.544 24.743 0.187 1.00 39.29 C ATOM 2327 O GLU C 70 13.435 25.175 -0.997 1.00 38.21 O ATOM 2328 CB GLU C 70 15.106 25.883 1.793 1.00 45.70 C ATOM 2329 CG GLU C 70 16.004 26.416 0.687 1.00 48.03 C ATOM 2330 CD GLU C 70 17.443 26.575 1.125 1.00 52.44 C ATOM 2331 OE1 GLU C 70 17.906 25.744 1.922 1.00 52.59 O ATOM 2332 OE2 GLU C 70 18.096 27.520 0.659 1.00 55.00 O ATOM 2333 H GLU C 70 13.191 25.188 3.396 1.00 0.00 H ATOM 2334 N MET C 71 13.554 23.444 0.475 1.00 35.81 N ATOM 2335 CA MET C 71 13.415 22.435 -0.632 1.00 36.74 C ATOM 2336 C MET C 71 12.058 22.576 -1.313 1.00 35.68 C ATOM 2337 O MET C 71 11.985 22.591 -2.555 1.00 33.00 O ATOM 2338 CB MET C 71 13.604 21.012 -0.143 1.00 37.62 C ATOM 2339 CG MET C 71 13.358 19.929 -1.230 1.00 38.14 C ATOM 2340 SD MET C 71 13.699 18.290 -0.590 1.00 42.91 S ATOM 2341 CE MET C 71 15.489 18.355 -0.636 1.00 48.69 C ATOM 2342 H MET C 71 13.657 23.128 1.460 1.00 0.00 H ATOM 2343 N ALA C 72 10.981 22.748 -0.530 1.00 31.60 N ATOM 2344 CA ALA C 72 9.663 22.958 -1.110 1.00 32.36 C ATOM 2345 C ALA C 72 9.636 24.156 -2.047 1.00 31.39 C ATOM 2346 O ALA C 72 9.146 24.079 -3.177 1.00 30.93 O ATOM 2347 CB ALA C 72 8.577 23.008 -0.057 1.00 27.65 C ATOM 2348 H ALA C 72 11.090 22.731 0.504 1.00 0.00 H ATOM 2349 N GLU C 73 10.168 25.283 -1.591 1.00 31.22 N ATOM 2350 CA GLU C 73 10.165 26.475 -2.380 1.00 33.60 C ATOM 2351 C GLU C 73 11.065 26.354 -3.651 1.00 35.09 C ATOM 2352 O GLU C 73 10.750 26.941 -4.634 1.00 36.75 O ATOM 2353 CB GLU C 73 10.592 27.686 -1.525 1.00 38.02 C ATOM 2354 CG GLU C 73 9.507 28.042 -0.517 1.00 38.10 C ATOM 2355 CD GLU C 73 9.578 29.450 -0.083 1.00 52.73 C ATOM 2356 OE1 GLU C 73 9.458 30.352 -0.985 1.00 59.84 O ATOM 2357 OE2 GLU C 73 9.760 29.638 1.153 1.00 47.50 O ATOM 2358 H GLU C 73 10.595 25.299 -0.643 1.00 0.00 H ATOM 2359 N GLU C 74 12.191 25.638 -3.606 1.00 36.63 N ATOM 2360 CA GLU C 74 13.032 25.422 -4.799 1.00 39.45 C ATOM 2361 C GLU C 74 12.268 24.612 -5.832 1.00 35.17 C ATOM 2362 O GLU C 74 12.322 24.935 -7.054 1.00 36.65 O ATOM 2363 CB GLU C 74 14.339 24.717 -4.455 1.00 45.12 C ATOM 2364 CG GLU C 74 15.241 25.599 -3.617 1.00 48.45 C ATOM 2365 CD GLU C 74 16.522 24.919 -3.129 1.00 57.84 C ATOM 2366 OE1 GLU C 74 16.748 23.752 -3.437 1.00 53.89 O ATOM 2367 OE2 GLU C 74 17.344 25.605 -2.457 1.00 68.24 O ATOM 2368 H GLU C 74 12.485 25.219 -2.701 1.00 0.00 H ATOM 2369 N ILE C 75 11.567 23.573 -5.375 1.00 31.97 N ATOM 2370 CA ILE C 75 10.699 22.810 -6.291 1.00 32.96 C ATOM 2371 C ILE C 75 9.626 23.729 -6.921 1.00 33.20 C ATOM 2372 O ILE C 75 9.462 23.722 -8.157 1.00 30.14 O ATOM 2373 CB ILE C 75 10.047 21.585 -5.664 1.00 28.90 C ATOM 2374 CG1 ILE C 75 11.104 20.574 -5.206 1.00 32.47 C ATOM 2375 CG2 ILE C 75 9.079 20.947 -6.632 1.00 29.94 C ATOM 2376 CD1 ILE C 75 10.481 19.544 -4.253 1.00 32.64 C ATOM 2377 H ILE C 75 11.633 23.301 -4.373 1.00 0.00 H ATOM 2378 N ALA C 76 8.946 24.513 -6.079 1.00 30.58 N ATOM 2379 CA ALA C 76 7.882 25.419 -6.482 1.00 32.15 C ATOM 2380 C ALA C 76 8.412 26.410 -7.495 1.00 31.94 C ATOM 2381 O ALA C 76 7.827 26.605 -8.567 1.00 32.01 O ATOM 2382 CB ALA C 76 7.262 26.113 -5.258 1.00 31.45 C ATOM 2383 H ALA C 76 9.194 24.473 -5.070 1.00 0.00 H ATOM 2384 N ASP C 77 9.566 27.009 -7.204 1.00 33.58 N ATOM 2385 CA ASP C 77 10.140 28.045 -8.058 1.00 34.63 C ATOM 2386 C ASP C 77 10.486 27.453 -9.419 1.00 35.89 C ATOM 2387 O ASP C 77 10.240 28.079 -10.457 1.00 36.37 O ATOM 2388 CB ASP C 77 11.410 28.590 -7.456 1.00 38.52 C ATOM 2389 CG ASP C 77 11.186 29.433 -6.175 1.00 42.83 C ATOM 2390 OD1 ASP C 77 10.064 29.788 -5.816 1.00 45.21 O ATOM 2391 OD2 ASP C 77 12.178 29.779 -5.538 1.00 43.73 O ATOM 2392 H ASP C 77 10.074 26.730 -6.341 1.00 0.00 H ATOM 2393 N ARG C 78 11.110 26.271 -9.408 1.00 35.40 N ATOM 2394 CA ARG C 78 11.664 25.634 -10.615 1.00 36.24 C ATOM 2395 C ARG C 78 10.457 25.284 -11.523 1.00 32.40 C ATOM 2396 O ARG C 78 10.484 25.531 -12.755 1.00 33.10 O ATOM 2397 CB ARG C 78 12.428 24.332 -10.276 1.00 40.90 C ATOM 2398 CG ARG C 78 13.949 24.218 -10.478 1.00 58.12 C ATOM 2399 CD ARG C 78 14.744 25.185 -9.610 1.00 65.04 C ATOM 2400 NE ARG C 78 15.986 24.737 -8.901 1.00 70.77 N ATOM 2401 CZ ARG C 78 16.948 23.896 -9.330 1.00 70.68 C ATOM 2402 NH1 ARG C 78 17.993 23.699 -8.534 1.00 71.49 N ATOM 2403 NH2 ARG C 78 16.917 23.240 -10.514 1.00 67.43 N ATOM 2404 HE ARG C 78 16.125 25.129 -7.948 1.00 0.00 H ATOM 2405 HH12 ARG C 78 18.757 23.058 -8.828 1.00 0.00 H ATOM 2406 HH11 ARG C 78 18.047 24.186 -7.617 1.00 0.00 H ATOM 2407 HH22 ARG C 78 17.698 22.606 -10.778 1.00 0.00 H ATOM 2408 HH21 ARG C 78 16.112 23.370 -11.160 1.00 0.00 H ATOM 2409 H ARG C 78 11.210 25.775 -8.499 1.00 0.00 H ATOM 2410 N VAL C 79 9.423 24.714 -10.910 1.00 31.74 N ATOM 2411 CA VAL C 79 8.207 24.295 -11.639 1.00 32.49 C ATOM 2412 C VAL C 79 7.470 25.524 -12.151 1.00 31.76 C ATOM 2413 O VAL C 79 7.126 25.589 -13.335 1.00 31.14 O ATOM 2414 CB VAL C 79 7.243 23.432 -10.825 1.00 31.28 C ATOM 2415 CG1 VAL C 79 5.916 23.306 -11.600 1.00 28.76 C ATOM 2416 CG2 VAL C 79 7.854 22.057 -10.472 1.00 31.74 C ATOM 2417 H VAL C 79 9.472 24.558 -9.883 1.00 0.00 H ATOM 2418 N ALA C 80 7.269 26.538 -11.333 1.00 30.79 N ATOM 2419 CA ALA C 80 6.481 27.678 -11.784 1.00 32.36 C ATOM 2420 C ALA C 80 7.131 28.505 -12.844 1.00 34.70 C ATOM 2421 O ALA C 80 6.423 28.986 -13.759 1.00 34.85 O ATOM 2422 CB ALA C 80 6.025 28.523 -10.648 1.00 34.37 C ATOM 2423 H ALA C 80 7.670 26.525 -10.373 1.00 0.00 H ATOM 2424 N VAL C 81 8.449 28.748 -12.731 1.00 32.30 N ATOM 2425 CA VAL C 81 9.145 29.545 -13.682 1.00 35.54 C ATOM 2426 C VAL C 81 9.226 28.794 -15.012 1.00 33.53 C ATOM 2427 O VAL C 81 9.053 29.369 -16.092 1.00 34.01 O ATOM 2428 CB VAL C 81 10.583 29.858 -13.209 1.00 38.86 C ATOM 2429 CG1 VAL C 81 11.339 30.479 -14.340 1.00 40.09 C ATOM 2430 CG2 VAL C 81 10.539 30.818 -12.033 1.00 42.41 C ATOM 2431 H VAL C 81 8.972 28.343 -11.929 1.00 0.00 H ATOM 2432 N LYS C 82 9.453 27.484 -14.944 1.00 32.54 N ATOM 2433 CA LYS C 82 9.648 26.732 -16.195 1.00 33.77 C ATOM 2434 C LYS C 82 8.338 26.557 -16.961 1.00 32.39 C ATOM 2435 O LYS C 82 8.373 26.597 -18.204 1.00 34.45 O ATOM 2436 CB LYS C 82 10.315 25.368 -15.956 1.00 37.24 C ATOM 2437 CG LYS C 82 10.789 24.711 -17.253 1.00 43.95 C ATOM 2438 CD LYS C 82 11.746 23.525 -17.064 1.00 47.31 C ATOM 2439 CE LYS C 82 12.197 23.000 -18.422 1.00 49.33 C ATOM 2440 NZ LYS C 82 13.569 22.438 -18.307 1.00 56.59 N ATOM 2441 HZ1 LYS C 82 14.222 23.183 -17.989 1.00 0.00 H ATOM 2442 HZ2 LYS C 82 13.567 21.659 -17.618 1.00 0.00 H ATOM 2443 HZ3 LYS C 82 13.875 22.080 -19.235 1.00 0.00 H ATOM 2444 H LYS C 82 9.492 27.000 -14.024 1.00 0.00 H ATOM 2445 N TYR C 83 7.205 26.457 -16.282 1.00 29.57 N ATOM 2446 CA TYR C 83 5.952 26.044 -16.910 1.00 32.40 C ATOM 2447 C TYR C 83 4.765 26.931 -16.683 1.00 32.10 C ATOM 2448 O TYR C 83 3.919 26.996 -17.542 1.00 32.68 O ATOM 2449 CB TYR C 83 5.560 24.588 -16.487 1.00 29.86 C ATOM 2450 CG TYR C 83 6.583 23.613 -16.888 1.00 30.30 C ATOM 2451 CD1 TYR C 83 6.850 23.357 -18.249 1.00 30.44 C ATOM 2452 CD2 TYR C 83 7.311 22.913 -15.918 1.00 33.01 C ATOM 2453 CE1 TYR C 83 7.828 22.490 -18.652 1.00 35.14 C ATOM 2454 CE2 TYR C 83 8.308 22.027 -16.305 1.00 34.00 C ATOM 2455 CZ TYR C 83 8.543 21.781 -17.632 1.00 36.42 C ATOM 2456 OH TYR C 83 9.573 20.919 -18.026 1.00 38.87 O ATOM 2457 HH TYR C 83 9.594 20.862 -19.014 1.00 0.00 H ATOM 2458 H TYR C 83 7.207 26.680 -15.266 1.00 0.00 H ATOM 2459 N PHE C 84 4.654 27.632 -15.562 1.00 32.51 N ATOM 2460 CA PHE C 84 3.338 28.254 -15.210 1.00 32.43 C ATOM 2461 C PHE C 84 3.036 29.634 -15.802 1.00 34.53 C ATOM 2462 O PHE C 84 2.004 30.220 -15.548 1.00 35.41 O ATOM 2463 CB PHE C 84 3.122 28.161 -13.716 1.00 31.28 C ATOM 2464 CG PHE C 84 2.893 26.697 -13.223 1.00 31.88 C ATOM 2465 CD1 PHE C 84 2.934 25.617 -14.080 1.00 33.28 C ATOM 2466 CD2 PHE C 84 2.612 26.439 -11.861 1.00 35.78 C ATOM 2467 CE1 PHE C 84 2.700 24.302 -13.653 1.00 35.56 C ATOM 2468 CE2 PHE C 84 2.422 25.149 -11.445 1.00 32.53 C ATOM 2469 CZ PHE C 84 2.462 24.089 -12.326 1.00 33.02 C ATOM 2470 H PHE C 84 5.474 27.749 -14.933 1.00 0.00 H ATOM 2471 N ASN C 85 3.946 30.150 -16.606 1.00 34.96 N ATOM 2472 CA ASN C 85 3.594 31.224 -17.511 1.00 36.45 C ATOM 2473 C ASN C 85 3.102 30.730 -18.855 1.00 36.36 C ATOM 2474 O ASN C 85 2.757 31.514 -19.683 1.00 36.68 O ATOM 2475 CB ASN C 85 4.796 32.166 -17.643 1.00 41.00 C ATOM 2476 CG ASN C 85 5.061 32.861 -16.335 1.00 43.72 C ATOM 2477 OD1 ASN C 85 4.133 33.228 -15.642 1.00 43.55 O ATOM 2478 ND2 ASN C 85 6.281 32.942 -15.945 1.00 46.89 N ATOM 2479 HD22 ASN C 85 7.048 32.617 -16.567 1.00 0.00 H ATOM 2480 HD21 ASN C 85 6.502 33.332 -15.007 1.00 0.00 H ATOM 2481 H ASN C 85 4.919 29.784 -16.590 1.00 0.00 H ATOM 2482 N ASP C 86 3.171 29.443 -19.104 1.00 34.89 N ATOM 2483 CA ASP C 86 2.746 28.861 -20.356 1.00 38.12 C ATOM 2484 C ASP C 86 1.594 27.800 -20.196 1.00 38.47 C ATOM 2485 O ASP C 86 0.954 27.427 -21.170 1.00 37.63 O ATOM 2486 CB ASP C 86 3.951 28.183 -20.966 1.00 36.03 C ATOM 2487 CG ASP C 86 5.076 29.220 -21.288 1.00 38.93 C ATOM 2488 OD1 ASP C 86 4.771 30.219 -22.003 1.00 37.92 O ATOM 2489 OD2 ASP C 86 6.205 29.043 -20.772 1.00 38.85 O ATOM 2490 H ASP C 86 3.549 28.814 -18.367 1.00 0.00 H ATOM 2491 N TYR C 87 1.508 27.234 -19.025 1.00 34.83 N ATOM 2492 CA TYR C 87 0.528 26.171 -18.659 1.00 34.82 C ATOM 2493 C TYR C 87 -0.176 26.599 -17.384 1.00 34.68 C ATOM 2494 O TYR C 87 0.353 27.413 -16.610 1.00 34.15 O ATOM 2495 CB TYR C 87 1.244 24.845 -18.429 1.00 34.37 C ATOM 2496 CG TYR C 87 1.973 24.275 -19.603 1.00 33.88 C ATOM 2497 CD1 TYR C 87 3.312 24.620 -19.892 1.00 32.57 C ATOM 2498 CD2 TYR C 87 1.365 23.345 -20.437 1.00 38.56 C ATOM 2499 CE1 TYR C 87 3.954 24.096 -20.973 1.00 35.09 C ATOM 2500 CE2 TYR C 87 2.042 22.785 -21.504 1.00 40.57 C ATOM 2501 CZ TYR C 87 3.322 23.167 -21.761 1.00 38.76 C ATOM 2502 OH TYR C 87 3.927 22.667 -22.816 1.00 42.12 O ATOM 2503 HH TYR C 87 4.845 23.034 -22.873 1.00 0.00 H ATOM 2504 H TYR C 87 2.173 27.548 -18.290 1.00 0.00 H ATOM 2505 N ALA C 88 -1.400 26.103 -17.155 1.00 34.65 N ATOM 2506 CA ALA C 88 -2.153 26.431 -15.968 1.00 33.09 C ATOM 2507 C ALA C 88 -1.573 25.649 -14.815 1.00 31.33 C ATOM 2508 O ALA C 88 -1.356 24.433 -14.918 1.00 32.34 O ATOM 2509 CB ALA C 88 -3.636 26.059 -16.116 1.00 36.35 C ATOM 2510 H ALA C 88 -1.821 25.460 -17.856 1.00 0.00 H ATOM 2511 N GLY C 89 -1.446 26.330 -13.688 1.00 30.87 N ATOM 2512 CA GLY C 89 -0.894 25.675 -12.470 1.00 33.11 C ATOM 2513 C GLY C 89 -1.123 26.478 -11.220 1.00 31.24 C ATOM 2514 O GLY C 89 -1.118 27.733 -11.249 1.00 31.73 O ATOM 2515 H GLY C 89 -1.733 27.329 -13.652 1.00 0.00 H ATOM 2516 N ILE C 90 -1.318 25.774 -10.091 1.00 28.94 N ATOM 2517 CA ILE C 90 -1.296 26.403 -8.781 1.00 28.80 C ATOM 2518 C ILE C 90 -0.342 25.577 -7.910 1.00 28.17 C ATOM 2519 O ILE C 90 -0.272 24.366 -8.028 1.00 26.13 O ATOM 2520 CB ILE C 90 -2.695 26.582 -8.170 1.00 30.47 C ATOM 2521 CG1 ILE C 90 -2.628 27.450 -6.926 1.00 32.54 C ATOM 2522 CG2 ILE C 90 -3.319 25.230 -7.793 1.00 30.95 C ATOM 2523 CD1 ILE C 90 -3.988 27.809 -6.376 1.00 37.13 C ATOM 2524 H ILE C 90 -1.489 24.750 -10.157 1.00 0.00 H ATOM 2525 N ILE C 91 0.364 26.269 -7.018 1.00 28.55 N ATOM 2526 CA ILE C 91 1.278 25.620 -6.101 1.00 26.70 C ATOM 2527 C ILE C 91 1.056 26.220 -4.734 1.00 28.11 C ATOM 2528 O ILE C 91 1.075 27.470 -4.582 1.00 31.14 O ATOM 2529 CB ILE C 91 2.772 25.806 -6.476 1.00 28.87 C ATOM 2530 CG1 ILE C 91 3.131 25.364 -7.924 1.00 29.53 C ATOM 2531 CG2 ILE C 91 3.646 25.068 -5.482 1.00 29.13 C ATOM 2532 CD1 ILE C 91 4.617 25.373 -8.296 1.00 29.55 C ATOM 2533 H ILE C 91 0.256 27.303 -6.979 1.00 0.00 H ATOM 2534 N TYR C 92 0.834 25.356 -3.740 1.00 27.41 N ATOM 2535 CA TYR C 92 0.636 25.763 -2.382 1.00 26.63 C ATOM 2536 C TYR C 92 1.311 24.856 -1.446 1.00 27.52 C ATOM 2537 O TYR C 92 1.715 23.761 -1.781 1.00 28.84 O ATOM 2538 CB TYR C 92 -0.799 25.959 -2.053 1.00 28.01 C ATOM 2539 CG TYR C 92 -1.705 24.763 -2.183 1.00 27.68 C ATOM 2540 CD1 TYR C 92 -2.347 24.432 -3.408 1.00 32.51 C ATOM 2541 CD2 TYR C 92 -1.949 23.991 -1.116 1.00 28.59 C ATOM 2542 CE1 TYR C 92 -3.253 23.321 -3.418 1.00 31.08 C ATOM 2543 CE2 TYR C 92 -2.845 22.907 -1.120 1.00 30.58 C ATOM 2544 CZ TYR C 92 -3.526 22.631 -2.312 1.00 32.16 C ATOM 2545 OH TYR C 92 -4.380 21.539 -2.317 1.00 37.64 O ATOM 2546 HH TYR C 92 -4.797 21.452 -3.211 1.00 0.00 H ATOM 2547 H TYR C 92 0.804 24.341 -3.963 1.00 0.00 H ATOM 2548 N ILE C 93 1.438 25.322 -0.213 1.00 28.45 N ATOM 2549 CA ILE C 93 2.136 24.560 0.782 1.00 29.15 C ATOM 2550 C ILE C 93 1.329 24.596 2.100 1.00 29.19 C ATOM 2551 O ILE C 93 0.726 25.611 2.455 1.00 31.67 O ATOM 2552 CB ILE C 93 3.567 25.175 0.947 1.00 33.33 C ATOM 2553 CG1 ILE C 93 4.559 24.370 1.792 1.00 38.82 C ATOM 2554 CG2 ILE C 93 3.517 26.579 1.469 1.00 35.13 C ATOM 2555 CD1 ILE C 93 6.001 24.884 1.476 1.00 39.55 C ATOM 2556 H ILE C 93 1.029 26.246 0.035 1.00 0.00 H ATOM 2557 N CYS C 94 1.324 23.452 2.778 1.00 30.47 N ATOM 2558 CA CYS C 94 0.625 23.218 4.100 1.00 35.61 C ATOM 2559 C CYS C 94 1.696 22.675 5.061 1.00 31.76 C ATOM 2560 O CYS C 94 2.649 22.001 4.641 1.00 33.65 O ATOM 2561 CB CYS C 94 -0.448 22.117 3.937 1.00 35.29 C ATOM 2562 SG CYS C 94 -1.732 22.752 2.775 1.00 48.62 S ATOM 2563 H CYS C 94 1.844 22.651 2.365 1.00 0.00 H ATOM 2564 N SER C 95 1.513 22.886 6.354 1.00 33.71 N ATOM 2565 CA SER C 95 2.354 22.264 7.326 1.00 33.55 C ATOM 2566 C SER C 95 1.885 20.832 7.524 1.00 33.82 C ATOM 2567 O SER C 95 0.707 20.527 7.456 1.00 37.08 O ATOM 2568 CB SER C 95 2.307 22.985 8.679 1.00 40.26 C ATOM 2569 OG SER C 95 2.768 24.298 8.440 1.00 46.40 O ATOM 2570 HG SER C 95 2.757 24.810 9.287 1.00 0.00 H ATOM 2571 H SER C 95 0.745 23.514 6.667 1.00 0.00 H ATOM 2572 N ALA C 96 2.819 19.958 7.833 1.00 31.32 N ATOM 2573 CA ALA C 96 2.491 18.572 8.211 1.00 30.38 C ATOM 2574 C ALA C 96 3.513 18.070 9.177 1.00 30.79 C ATOM 2575 O ALA C 96 4.574 18.671 9.332 1.00 31.85 O ATOM 2576 CB ALA C 96 2.455 17.666 6.966 1.00 31.19 C ATOM 2577 H ALA C 96 3.816 20.254 7.810 1.00 0.00 H ATOM 2578 N GLU C 97 3.164 17.031 9.868 1.00 28.95 N ATOM 2579 CA GLU C 97 4.147 16.280 10.644 1.00 31.40 C ATOM 2580 C GLU C 97 4.190 14.825 10.209 1.00 32.72 C ATOM 2581 O GLU C 97 3.137 14.178 10.177 1.00 30.71 O ATOM 2582 CB GLU C 97 3.861 16.307 12.114 1.00 36.94 C ATOM 2583 CG GLU C 97 3.792 17.661 12.765 1.00 42.19 C ATOM 2584 CD GLU C 97 3.253 17.509 14.155 1.00 47.51 C ATOM 2585 OE1 GLU C 97 2.049 17.742 14.417 1.00 51.39 O ATOM 2586 OE2 GLU C 97 4.031 17.083 14.967 1.00 48.87 O ATOM 2587 H GLU C 97 2.169 16.727 9.870 1.00 0.00 H ATOM 2588 N VAL C 98 5.377 14.319 9.908 1.00 29.19 N ATOM 2589 CA VAL C 98 5.525 12.918 9.500 1.00 28.68 C ATOM 2590 C VAL C 98 5.690 12.016 10.679 1.00 32.30 C ATOM 2591 O VAL C 98 6.645 12.164 11.515 1.00 30.96 O ATOM 2592 CB VAL C 98 6.626 12.759 8.404 1.00 28.47 C ATOM 2593 CG1 VAL C 98 6.816 11.274 8.064 1.00 30.35 C ATOM 2594 CG2 VAL C 98 6.280 13.554 7.168 1.00 29.57 C ATOM 2595 H VAL C 98 6.219 14.927 9.962 1.00 0.00 H ATOM 2596 N LEU C 99 4.816 11.014 10.811 1.00 29.03 N ATOM 2597 CA LEU C 99 4.889 10.060 11.897 1.00 31.25 C ATOM 2598 C LEU C 99 5.633 8.795 11.545 1.00 30.94 C ATOM 2599 O LEU C 99 6.348 8.227 12.370 1.00 30.05 O ATOM 2600 CB LEU C 99 3.446 9.694 12.349 1.00 34.16 C ATOM 2601 CG LEU C 99 2.555 10.874 12.740 1.00 36.18 C ATOM 2602 CD1 LEU C 99 1.160 10.334 13.120 1.00 36.67 C ATOM 2603 CD2 LEU C 99 3.106 11.518 13.999 1.00 41.75 C ATOM 2604 H LEU C 99 4.056 10.916 10.108 1.00 0.00 H ATOM 2605 N TYR C 100 5.480 8.348 10.298 1.00 31.12 N ATOM 2606 CA TYR C 100 6.210 7.156 9.789 1.00 30.96 C ATOM 2607 C TYR C 100 6.595 7.423 8.392 1.00 34.00 C ATOM 2608 O TYR C 100 5.794 7.938 7.578 1.00 29.46 O ATOM 2609 CB TYR C 100 5.389 5.869 9.915 1.00 32.29 C ATOM 2610 CG TYR C 100 5.153 5.462 11.318 1.00 31.87 C ATOM 2611 CD1 TYR C 100 6.113 4.803 12.048 1.00 35.24 C ATOM 2612 CD2 TYR C 100 3.990 5.808 11.963 1.00 31.12 C ATOM 2613 CE1 TYR C 100 5.933 4.452 13.361 1.00 35.65 C ATOM 2614 CE2 TYR C 100 3.794 5.509 13.283 1.00 33.26 C ATOM 2615 CZ TYR C 100 4.771 4.832 14.013 1.00 34.93 C ATOM 2616 OH TYR C 100 4.620 4.460 15.302 1.00 34.73 O ATOM 2617 HH TYR C 100 4.466 5.263 15.860 1.00 0.00 H ATOM 2618 H TYR C 100 4.829 8.849 9.660 1.00 0.00 H ATOM 2619 N GLY C 101 7.819 7.066 8.029 1.00 32.83 N ATOM 2620 CA GLY C 101 8.206 7.280 6.655 1.00 35.07 C ATOM 2621 C GLY C 101 9.679 6.898 6.534 1.00 39.47 C ATOM 2622 O GLY C 101 10.519 7.689 6.921 1.00 37.04 O ATOM 2623 H GLY C 101 8.480 6.645 8.713 1.00 0.00 H ATOM 2624 N HIS C 102 9.978 5.703 6.044 1.00 39.97 N ATOM 2625 CA HIS C 102 11.366 5.214 6.142 1.00 48.17 C ATOM 2626 C HIS C 102 12.376 6.119 5.499 1.00 44.41 C ATOM 2627 O HIS C 102 13.365 6.465 6.142 1.00 45.22 O ATOM 2628 CB HIS C 102 11.495 3.751 5.717 1.00 54.24 C ATOM 2629 CG HIS C 102 11.132 2.827 6.825 1.00 65.74 C ATOM 2630 ND1 HIS C 102 11.857 2.762 8.002 1.00 77.70 N ATOM 2631 CD2 HIS C 102 10.116 1.943 6.964 1.00 73.58 C ATOM 2632 CE1 HIS C 102 11.308 1.869 8.811 1.00 76.93 C ATOM 2633 NE2 HIS C 102 10.249 1.358 8.206 1.00 70.64 N ATOM 2634 H HIS C 102 9.244 5.118 5.596 1.00 0.00 H ATOM 2635 N THR C 103 12.095 6.535 4.276 1.00 42.16 N ATOM 2636 CA THR C 103 13.008 7.370 3.527 1.00 46.75 C ATOM 2637 C THR C 103 12.899 8.828 3.976 1.00 46.45 C ATOM 2638 O THR C 103 13.914 9.522 4.007 1.00 47.22 O ATOM 2639 CB THR C 103 12.805 7.260 2.008 1.00 46.80 C ATOM 2640 OG1 THR C 103 11.536 7.756 1.660 1.00 50.73 O ATOM 2641 CG2 THR C 103 12.861 5.827 1.541 1.00 50.97 C ATOM 2642 HG1 THR C 103 11.468 8.705 1.932 1.00 0.00 H ATOM 2643 H THR C 103 11.193 6.254 3.841 1.00 0.00 H ATOM 2644 N PHE C 104 11.703 9.281 4.381 1.00 39.54 N ATOM 2645 CA PHE C 104 11.523 10.658 4.847 1.00 37.57 C ATOM 2646 C PHE C 104 12.250 10.886 6.143 1.00 38.44 C ATOM 2647 O PHE C 104 13.002 11.810 6.258 1.00 41.92 O ATOM 2648 CB PHE C 104 10.040 11.077 4.967 1.00 34.54 C ATOM 2649 CG PHE C 104 9.858 12.542 5.272 1.00 32.27 C ATOM 2650 CD1 PHE C 104 9.826 12.994 6.568 1.00 32.53 C ATOM 2651 CD2 PHE C 104 9.730 13.438 4.298 1.00 32.40 C ATOM 2652 CE1 PHE C 104 9.663 14.311 6.866 1.00 35.21 C ATOM 2653 CE2 PHE C 104 9.664 14.781 4.582 1.00 33.99 C ATOM 2654 CZ PHE C 104 9.566 15.222 5.873 1.00 34.53 C ATOM 2655 H PHE C 104 10.885 8.640 4.364 1.00 0.00 H ATOM 2656 N CYS C 105 12.049 10.051 7.126 1.00 39.51 N ATOM 2657 CA CYS C 105 12.650 10.314 8.401 1.00 45.27 C ATOM 2658 C CYS C 105 14.037 9.703 8.544 1.00 49.92 C ATOM 2659 O CYS C 105 14.729 10.081 9.476 1.00 50.54 O ATOM 2660 CB CYS C 105 11.796 9.802 9.505 1.00 47.65 C ATOM 2661 SG CYS C 105 10.170 10.613 9.569 1.00 45.78 S ATOM 2662 H CYS C 105 11.460 9.205 6.986 1.00 0.00 H ATOM 2663 N GLY C 106 14.404 8.765 7.643 1.00 51.56 N ATOM 2664 CA GLY C 106 15.757 8.123 7.659 1.00 57.85 C ATOM 2665 C GLY C 106 15.734 6.869 8.488 1.00 64.55 C ATOM 2666 O GLY C 106 14.648 6.468 8.931 1.00 65.10 O ATOM 2667 H GLY C 106 13.722 8.479 6.912 1.00 0.00 H ATOM 2668 N PRO C 107 16.920 6.240 8.718 1.00 70.93 N ATOM 2669 CA PRO C 107 16.982 5.098 9.641 1.00 73.86 C ATOM 2670 C PRO C 107 16.795 5.588 11.082 1.00 68.58 C ATOM 2671 O PRO C 107 16.296 4.847 11.930 1.00 72.50 O ATOM 2672 CB PRO C 107 18.413 4.530 9.425 1.00 81.14 C ATOM 2673 CG PRO C 107 19.230 5.699 8.957 1.00 82.06 C ATOM 2674 CD PRO C 107 18.261 6.648 8.245 1.00 75.88 C ATOM 2675 N GLU C 108 17.201 6.836 11.329 1.00 69.66 N ATOM 2676 CA GLU C 108 16.971 7.550 12.587 1.00 70.52 C ATOM 2677 C GLU C 108 15.486 7.625 13.038 1.00 73.61 C ATOM 2678 O GLU C 108 15.228 8.005 14.181 1.00 82.00 O ATOM 2679 CB GLU C 108 17.528 8.975 12.422 1.00 70.21 C ATOM 2680 H GLU C 108 17.716 7.335 10.576 1.00 0.00 H ATOM 2681 N GLY C 109 14.519 7.311 12.145 1.00 65.75 N ATOM 2682 CA GLY C 109 13.078 7.276 12.490 1.00 57.31 C ATOM 2683 C GLY C 109 12.535 8.678 12.629 1.00 54.48 C ATOM 2684 O GLY C 109 13.265 9.656 12.501 1.00 52.53 O ATOM 2685 H GLY C 109 14.800 7.083 11.170 1.00 0.00 H ATOM 2686 N CYS C 110 11.244 8.800 12.895 1.00 51.28 N ATOM 2687 CA CYS C 110 10.598 10.097 12.868 1.00 47.52 C ATOM 2688 C CYS C 110 10.681 10.890 14.175 1.00 51.67 C ATOM 2689 O CYS C 110 9.810 11.686 14.444 1.00 45.47 O ATOM 2690 CB CYS C 110 9.160 9.925 12.363 1.00 43.94 C ATOM 2691 SG CYS C 110 9.144 9.304 10.605 1.00 46.70 S ATOM 2692 H CYS C 110 10.686 7.954 13.126 1.00 0.00 H ATOM 2693 N SER C 111 11.794 10.744 14.917 1.00 57.30 N ATOM 2694 CA SER C 111 11.964 11.323 16.304 1.00 66.84 C ATOM 2695 C SER C 111 10.650 11.338 17.140 1.00 61.82 C ATOM 2696 O SER C 111 10.044 12.374 17.460 1.00 55.40 O ATOM 2697 CB SER C 111 12.702 12.682 16.307 1.00 71.33 C ATOM 2698 OG SER C 111 12.156 13.575 15.376 1.00 72.06 O ATOM 2699 HG SER C 111 11.204 13.738 15.595 1.00 0.00 H ATOM 2700 H SER C 111 12.584 10.201 14.513 1.00 0.00 H ATOM 2701 N ALA C 112 10.261 10.121 17.478 1.00 58.68 N ATOM 2702 CA ALA C 112 8.991 9.813 18.083 1.00 58.29 C ATOM 2703 C ALA C 112 8.690 10.650 19.332 1.00 60.38 C ATOM 2704 O ALA C 112 7.531 11.010 19.541 1.00 63.95 O ATOM 2705 CB ALA C 112 8.940 8.314 18.415 1.00 59.58 C ATOM 2706 H ALA C 112 10.915 9.334 17.295 1.00 0.00 H ATOM 2707 N TRP C 113 9.719 10.981 20.121 1.00 55.19 N ATOM 2708 CA TRP C 113 9.534 11.708 21.409 1.00 62.30 C ATOM 2709 C TRP C 113 9.738 13.226 21.380 1.00 65.23 C ATOM 2710 O TRP C 113 9.985 13.842 22.408 1.00 72.28 O ATOM 2711 CB TRP C 113 10.458 11.084 22.453 1.00 61.49 C ATOM 2712 CG TRP C 113 10.174 9.652 22.591 1.00 59.59 C ATOM 2713 CD1 TRP C 113 10.895 8.608 22.100 1.00 58.89 C ATOM 2714 CD2 TRP C 113 9.020 9.108 23.169 1.00 60.43 C ATOM 2715 NE1 TRP C 113 10.268 7.426 22.360 1.00 58.76 N ATOM 2716 CE2 TRP C 113 9.101 7.701 23.021 1.00 60.98 C ATOM 2717 CE3 TRP C 113 7.905 9.670 23.796 1.00 62.74 C ATOM 2718 CZ2 TRP C 113 8.111 6.840 23.498 1.00 61.67 C ATOM 2719 CZ3 TRP C 113 6.923 8.836 24.250 1.00 65.57 C ATOM 2720 CH2 TRP C 113 7.030 7.418 24.108 1.00 65.06 C ATOM 2721 HE1 TRP C 113 10.615 6.480 22.101 1.00 0.00 H ATOM 2722 H TRP C 113 10.682 10.722 19.825 1.00 0.00 H ATOM 2723 N SER C 114 9.656 13.824 20.206 1.00 65.66 N ATOM 2724 CA SER C 114 9.815 15.261 20.084 1.00 77.01 C ATOM 2725 C SER C 114 8.466 15.925 19.796 1.00 76.29 C ATOM 2726 O SER C 114 7.715 16.224 20.728 1.00 80.15 O ATOM 2727 CB SER C 114 10.820 15.546 18.978 1.00 81.23 C ATOM 2728 OG SER C 114 11.977 14.746 19.170 1.00 81.54 O ATOM 2729 HG SER C 114 12.629 14.933 18.449 1.00 0.00 H ATOM 2730 H SER C 114 9.474 13.256 19.354 1.00 0.00 H TER 2731 SER C 114 HETATM 2732 O HOH 1 -5.096 35.728 1.659 1.00 56.38 O HETATM 2733 O HOH 2 1.851 26.904 4.906 1.00 50.26 O HETATM 2734 O HOH 3 -25.181 17.597 -8.819 1.00 49.28 O HETATM 2735 O HOH 4 -21.431 9.079 -3.951 1.00 47.12 O HETATM 2736 O HOH 5 -5.959 21.041 -4.439 1.00 36.41 O HETATM 2737 O HOH 6 6.669 32.986 -1.325 1.00 45.93 O HETATM 2738 O HOH 7 -11.356 37.532 -1.497 1.00 44.53 O HETATM 2739 O HOH 8 -14.528 28.680 -9.302 1.00 51.49 O HETATM 2740 O HOH 9 -15.341 28.940 11.863 1.00 42.69 O HETATM 2741 O HOH 10 5.242 31.591 5.844 1.00 54.50 O HETATM 2742 O HOH 11 -8.910 28.773 7.572 1.00 40.35 O HETATM 2743 O HOH 12 5.208 38.333 -5.834 1.00 55.79 O HETATM 2744 O HOH 13 -19.041 33.655 5.374 1.00 47.83 O HETATM 2745 O HOH 14 1.209 35.634 -10.730 1.00 45.57 O HETATM 2746 O HOH 15 -10.220 31.467 -4.585 1.00 37.11 O HETATM 2747 O HOH 16 -22.889 15.916 7.362 1.00 40.91 O HETATM 2748 O HOH 17 -14.285 37.529 1.461 1.00 42.24 O HETATM 2749 O HOH 18 -24.819 14.766 5.979 1.00 58.24 O HETATM 2750 O HOH 19 1.851 33.148 3.844 1.00 51.42 O HETATM 2751 O HOH 20 -6.741 30.253 -8.280 1.00 37.35 O HETATM 2752 O HOH 21 -3.739 30.406 6.225 1.00 49.46 O HETATM 2753 O HOH 22 -4.564 24.021 9.251 1.00 45.80 O HETATM 2754 O HOH 23 -0.533 24.762 7.089 1.00 44.67 O HETATM 2755 O HOH 24 -5.989 21.568 -17.452 1.00 47.02 O HETATM 2756 O HOH 25 -21.945 30.393 -3.332 1.00 55.81 O HETATM 2757 O HOH 26 -7.903 32.532 7.752 1.00 38.99 O HETATM 2758 O HOH 27 6.421 32.027 -4.134 1.00 43.90 O HETATM 2759 O HOH 28 -23.670 9.889 -5.555 1.00 55.49 O HETATM 2760 O HOH 29 -14.575 4.428 10.468 1.00 47.87 O HETATM 2761 O HOH 30 1.939 33.341 -9.345 1.00 37.46 O HETATM 2762 O HOH 31 -11.622 34.972 -4.490 1.00 44.36 O HETATM 2763 O HOH 32 3.859 33.867 -7.264 1.00 37.41 O HETATM 2764 O HOH 33 -4.239 30.721 -9.285 1.00 38.89 O HETATM 2765 O HOH 34 -7.183 27.605 8.963 1.00 50.08 O HETATM 2766 O HOH 35 -9.658 33.848 -3.294 1.00 35.69 O HETATM 2767 O HOH 36 -6.322 14.309 -2.288 1.00 47.76 O HETATM 2768 O HOH 37 -14.634 6.615 -6.974 1.00 51.35 O HETATM 2769 O HOH 38 5.547 34.978 2.574 1.00 63.57 O HETATM 2770 O HOH 39 -11.704 34.918 -0.724 1.00 44.77 O HETATM 2771 O HOH 40 -7.808 35.243 -4.289 1.00 45.96 O HETATM 2772 O HOH 41 -1.239 30.076 6.465 1.00 48.55 O HETATM 2773 O HOH 42 -0.251 27.324 6.175 1.00 52.59 O HETATM 2774 O HOH 43 -27.780 12.859 5.761 1.00 60.24 O HETATM 2775 O HOH 44 0.128 38.251 -2.676 1.00 65.90 O HETATM 2776 O HOH 45 2.495 31.236 -11.348 1.00 38.10 O HETATM 2777 O HOH 46 3.848 36.361 -10.961 1.00 53.77 O HETATM 2778 O HOH 47 -25.980 20.492 7.880 1.00 62.63 O HETATM 2779 O HOH 48 -12.941 39.119 -0.307 1.00 48.03 O HETATM 2780 O HOH 49 -16.666 36.453 0.328 1.00 51.25 O HETATM 2781 O HOH 50 -12.231 18.040 18.405 1.00 57.50 O HETATM 2782 O HOH 51 -10.593 13.824 3.072 1.00 43.42 O HETATM 2783 O HOH 52 9.617 9.914 1.709 1.00 40.96 O HETATM 2784 O HOH 53 -1.948 17.432 16.196 1.00 55.56 O HETATM 2785 O HOH 54 -4.211 -5.568 10.714 1.00 51.07 O HETATM 2786 O HOH 55 -5.511 -5.597 2.913 1.00 41.67 O HETATM 2787 O HOH 56 1.838 -0.556 -8.762 1.00 47.11 O HETATM 2788 O HOH 57 -0.299 -0.712 -4.465 1.00 48.15 O HETATM 2789 O HOH 58 -0.516 11.348 20.159 1.00 57.27 O HETATM 2790 O HOH 59 -6.337 -5.130 9.990 1.00 43.76 O HETATM 2791 O HOH 60 -4.436 -6.733 13.476 1.00 48.39 O HETATM 2792 O HOH 61 -8.110 25.086 9.969 1.00 43.87 O HETATM 2793 O HOH 62 2.605 7.941 15.831 1.00 46.08 O HETATM 2794 O HOH 63 -14.434 -0.030 6.439 1.00 50.46 O HETATM 2795 O HOH 64 7.691 1.199 4.954 1.00 40.95 O HETATM 2796 O HOH 65 -24.383 17.800 12.586 1.00 46.50 O HETATM 2797 O HOH 66 -13.233 10.374 13.519 1.00 33.77 O HETATM 2798 O HOH 67 5.632 -5.302 8.357 1.00 54.67 O HETATM 2799 O HOH 68 -16.959 11.571 10.530 1.00 44.73 O HETATM 2800 O HOH 69 -19.288 7.152 19.417 1.00 72.40 O HETATM 2801 O HOH 70 3.613 12.483 17.390 1.00 49.65 O HETATM 2802 O HOH 71 -3.804 2.996 -7.168 1.00 38.08 O HETATM 2803 O HOH 72 -11.603 -4.173 5.966 1.00 47.58 O HETATM 2804 O HOH 73 -19.042 18.325 18.466 1.00 61.14 O HETATM 2805 O HOH 74 -7.351 0.354 15.462 1.00 36.67 O HETATM 2806 O HOH 75 -7.179 -5.438 12.718 1.00 43.99 O HETATM 2807 O HOH 76 7.773 3.747 5.978 1.00 36.50 O HETATM 2808 O HOH 77 -1.124 21.230 10.202 1.00 47.82 O HETATM 2809 O HOH 78 -21.990 21.660 11.829 1.00 43.57 O HETATM 2810 O HOH 79 -15.503 13.228 16.494 1.00 45.95 O HETATM 2811 O HOH 80 -22.630 19.011 10.992 1.00 38.52 O HETATM 2812 O HOH 81 -5.809 15.793 20.825 1.00 43.08 O HETATM 2813 O HOH 82 -9.697 7.248 -6.295 1.00 37.13 O HETATM 2814 O HOH 83 -6.799 20.935 15.112 1.00 62.18 O HETATM 2815 O HOH 84 -8.065 5.564 19.324 1.00 59.44 O HETATM 2816 O HOH 85 4.043 0.414 -4.463 1.00 61.48 O HETATM 2817 O HOH 86 -19.023 13.601 9.720 1.00 41.88 O HETATM 2818 O HOH 87 -8.621 28.421 13.465 1.00 47.35 O HETATM 2819 O HOH 88 -8.101 -6.136 16.069 1.00 52.35 O HETATM 2820 O HOH 89 -23.489 23.681 15.225 1.00 48.78 O HETATM 2821 O HOH 90 -17.309 27.220 12.303 1.00 49.15 O HETATM 2822 O HOH 91 -13.335 11.505 16.024 1.00 36.59 O HETATM 2823 O HOH 92 8.298 3.494 2.324 1.00 46.18 O HETATM 2824 O HOH 93 -23.288 17.182 18.981 1.00 60.81 O HETATM 2825 O HOH 94 -10.660 11.005 18.257 1.00 44.50 O HETATM 2826 O HOH 95 -3.397 4.459 -9.272 1.00 42.57 O HETATM 2827 O HOH 96 -14.215 9.340 17.251 1.00 45.94 O HETATM 2828 O HOH 97 12.019 -6.138 6.477 1.00 51.06 O HETATM 2829 O HOH 98 -10.312 1.236 -5.986 1.00 60.54 O HETATM 2830 O HOH 99 -0.118 -3.230 -3.786 1.00 45.71 O HETATM 2831 O HOH 100 -1.603 18.199 13.996 1.00 59.18 O HETATM 2832 O HOH 101 -20.309 10.224 6.483 1.00 61.28 O HETATM 2833 O HOH 102 13.303 4.437 -1.747 1.00 64.96 O HETATM 2834 O HOH 103 -23.813 18.570 8.264 1.00 44.26 O HETATM 2835 O HOH 104 8.189 5.782 0.395 1.00 54.46 O HETATM 2836 O HOH 105 -1.157 -2.320 -6.709 1.00 49.11 O HETATM 2837 O HOH 106 -6.657 19.871 17.367 1.00 63.37 O HETATM 2838 O HOH 107 11.880 18.161 9.102 1.00 49.84 O HETATM 2839 O HOH 108 16.232 8.726 3.554 1.00 54.33 O HETATM 2840 O HOH 109 -5.006 18.591 -17.710 1.00 43.53 O HETATM 2841 O HOH 110 0.144 12.694 0.102 1.00 40.85 O HETATM 2842 O HOH 111 -4.169 15.079 2.113 1.00 61.78 O HETATM 2843 O HOH 112 15.021 13.190 -5.405 1.00 60.83 O HETATM 2844 O HOH 113 -3.452 20.510 -21.448 1.00 45.61 O HETATM 2845 O HOH 114 9.330 9.786 -11.231 1.00 45.30 O HETATM 2846 O HOH 115 6.431 32.170 -21.556 1.00 38.98 O HETATM 2847 O HOH 116 0.276 12.816 -18.365 1.00 49.83 O HETATM 2848 O HOH 117 10.112 20.904 -20.591 1.00 44.55 O HETATM 2849 O HOH 118 14.895 12.310 10.845 1.00 60.16 O HETATM 2850 O HOH 119 -1.556 23.515 -22.552 1.00 42.77 O HETATM 2851 O HOH 120 5.721 21.866 9.300 1.00 60.61 O HETATM 2852 O HOH 121 8.737 31.862 -16.913 1.00 33.45 O HETATM 2853 O HOH 122 11.251 14.605 0.888 1.00 36.28 O HETATM 2854 O HOH 123 8.434 29.717 -3.717 1.00 43.22 O HETATM 2855 O HOH 124 11.065 19.132 -16.565 1.00 40.12 O HETATM 2856 O HOH 125 -2.866 26.236 -20.811 1.00 61.43 O HETATM 2857 O HOH 126 7.246 26.412 -20.651 1.00 36.15 O HETATM 2858 O HOH 127 5.873 10.908 16.549 1.00 46.27 O HETATM 2859 O HOH 128 4.054 18.775 -22.103 1.00 50.63 O HETATM 2860 O HOH 129 0.435 18.511 12.346 1.00 47.07 O HETATM 2861 O HOH 130 12.196 5.448 9.644 1.00 52.37 O HETATM 2862 O HOH 131 -7.877 13.650 -14.596 1.00 56.13 O HETATM 2863 O HOH 132 -0.001 30.122 -12.036 1.00 32.21 O HETATM 2864 O HOH 133 9.876 12.073 -15.341 1.00 45.61 O HETATM 2865 O HOH 134 2.522 30.460 -23.613 1.00 47.28 O HETATM 2866 O HOH 135 -10.082 11.999 -9.791 1.00 40.78 O HETATM 2867 O HOH 136 9.529 5.636 9.690 1.00 37.91 O HETATM 2868 O HOH 137 5.479 15.962 -19.138 1.00 38.83 O HETATM 2869 O HOH 138 7.524 31.505 0.878 1.00 48.09 O HETATM 2870 O HOH 139 5.605 8.530 15.096 1.00 46.60 O HETATM 2871 O HOH 140 6.465 29.295 -17.911 1.00 30.43 O HETATM 2872 O HOH 141 15.763 11.853 5.367 1.00 58.35 O HETATM 2873 O HOH 142 12.837 15.745 2.688 1.00 39.16 O HETATM 2874 O HOH 143 14.755 28.611 -6.238 1.00 51.11 O HETATM 2875 O HOH 144 -0.619 29.184 -14.494 1.00 35.04 O HETATM 2876 O HOH 145 -3.556 29.398 -11.362 1.00 46.18 O HETATM 2877 O HOH 146 11.189 11.748 -5.943 1.00 49.14 O HETATM 2878 O HOH 147 13.698 14.173 4.582 1.00 51.65 O HETATM 2879 O HOH 148 1.955 34.520 -17.218 1.00 52.94 O HETATM 2880 O HOH 149 3.590 13.327 -18.885 1.00 40.62 O HETATM 2881 O HOH 150 -5.527 27.970 -12.140 1.00 41.86 O HETATM 2882 O HOH 151 -5.331 8.952 -9.449 1.00 40.69 O HETATM 2883 O HOH 152 9.039 8.016 3.704 1.00 39.87 O HETATM 2884 O HOH 153 17.622 2.286 12.876 1.00 56.01 O HETATM 2885 O HOH 154 8.920 6.568 12.656 1.00 43.88 O HETATM 2886 O HOH 155 4.669 31.448 -13.104 1.00 43.54 O HETATM 2887 O HOH 156 14.079 18.934 2.476 1.00 43.87 O HETATM 2888 O HOH 157 -3.287 18.138 -19.966 1.00 37.75 O HETATM 2889 O HOH 158 -0.297 30.328 -17.769 1.00 57.85 O HETATM 2890 O HOH 159 8.139 3.806 8.849 1.00 43.97 O HETATM 2891 O HOH 160 1.361 20.380 11.023 1.00 46.80 O HETATM 2892 O HOH 161 -2.584 29.245 -18.600 1.00 65.20 O HETATM 2893 O HOH 162 8.004 22.805 9.143 1.00 64.71 O HETATM 2894 O HOH 163 8.020 10.138 -14.263 1.00 60.93 O HETATM 2895 O HOH 164 -7.978 6.108 -13.596 1.00 59.04 O HETATM 2896 O HOH 165 11.842 17.310 -18.756 1.00 52.78 O HETATM 2897 O HOH 166 6.588 14.970 -21.354 1.00 43.30 O HETATM 2898 O HOH 167 16.350 18.075 3.646 1.00 56.74 O HETATM 2899 P CMP A 168 -6.613 24.190 -14.306 1.00 0.26 P HETATM 2900 O1P CMP A 168 -6.959 23.222 -15.445 1.00 -0.62 O HETATM 2901 O2P CMP A 168 -6.747 25.617 -14.631 1.00 -0.62 O HETATM 2902 O5' CMP A 168 -5.092 23.846 -13.896 1.00 -0.25 O HETATM 2903 C5' CMP A 168 -4.602 24.361 -12.619 1.00 0.11 C HETATM 2904 C4' CMP A 168 -5.578 23.821 -11.644 1.00 0.12 C HETATM 2905 O4' CMP A 168 -5.362 24.258 -10.292 1.00 -0.34 O HETATM 2906 C1' CMP A 168 -6.584 24.105 -9.584 1.00 0.20 C HETATM 2907 C2' CMP A 168 -7.697 23.745 -10.663 1.00 0.14 C HETATM 2908 C3' CMP A 168 -7.009 24.200 -11.880 1.00 0.15 C HETATM 2909 O3' CMP A 168 -7.462 23.625 -13.107 1.00 -0.25 O HETATM 2910 H4 CMP A 168 -7.107 25.293 -11.961 1.00 0.07 H HETATM 2911 O2' CMP A 168 -7.890 22.330 -10.556 1.00 -0.38 O HETATM 2912 H6 CMP A 168 -8.340 22.133 -9.742 1.00 0.21 H HETATM 2913 H5 CMP A 168 -8.649 24.276 -10.513 1.00 0.07 H HETATM 2914 N9 CMP A 168 -6.894 25.423 -8.991 1.00 -0.19 N HETATM 2915 C8 CMP A 168 -6.700 26.619 -9.453 1.00 0.11 C HETATM 2916 N7 CMP A 168 -7.120 27.542 -8.549 1.00 -0.30 N HETATM 2917 C5 CMP A 168 -7.572 26.858 -7.466 1.00 0.10 C HETATM 2918 C6 CMP A 168 -8.124 27.209 -6.134 1.00 0.13 C HETATM 2919 N6 CMP A 168 -8.264 28.537 -5.903 1.00 -0.32 N HETATM 2920 H9 CMP A 168 -8.640 28.866 -5.003 1.00 0.18 H HETATM 2921 H10 CMP A 168 -7.994 29.217 -6.628 1.00 0.18 H HETATM 2922 N1 CMP A 168 -8.434 26.183 -5.303 1.00 -0.27 N HETATM 2923 C2 CMP A 168 -8.243 24.858 -5.627 1.00 0.05 C HETATM 2924 N3 CMP A 168 -7.714 24.514 -6.861 1.00 -0.27 N HETATM 2925 C4 CMP A 168 -7.377 25.451 -7.724 1.00 0.16 C HETATM 2926 H11 CMP A 168 -8.507 24.083 -4.916 1.00 0.10 H HETATM 2927 H8 CMP A 168 -6.264 26.850 -10.424 1.00 0.13 H HETATM 2928 H7 CMP A 168 -6.512 23.326 -8.810 1.00 0.10 H HETATM 2929 H3 CMP A 168 -5.490 22.725 -11.687 1.00 0.07 H HETATM 2930 H1 CMP A 168 -4.602 25.461 -12.610 1.00 0.06 H HETATM 2931 H2 CMP A 168 -3.587 23.993 -12.408 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 356 357 361 362 363 CONECT 361 356 CONECT 362 356 CONECT 363 356 CONECT 847 846 877 CONECT 877 847 876 CONECT 888 889 893 894 895 CONECT 893 888 CONECT 894 888 CONECT 895 888 CONECT 1250 1251 1257 1258 1259 CONECT 1257 1250 CONECT 1258 1250 CONECT 1259 1250 CONECT 1749 1748 1779 CONECT 1779 1749 1778 CONECT 1820 1821 1825 1826 1827 CONECT 1825 1820 CONECT 1826 1820 CONECT 1827 1820 CONECT 2183 2184 2191 2192 2193 CONECT 2191 2183 CONECT 2192 2183 CONECT 2193 2183 CONECT 2661 2660 2691 CONECT 2691 2661 2690 CONECT 2899 2900 2901 2902 2909 CONECT 2900 2899 CONECT 2901 2899 CONECT 2902 2899 2903 CONECT 2903 2902 2904 2930 2931 CONECT 2904 2903 2905 2908 2929 CONECT 2905 2904 2906 CONECT 2906 2905 2907 2914 2928 CONECT 2907 2906 2908 2911 2913 CONECT 2908 2904 2907 2909 2910 CONECT 2909 2899 2908 CONECT 2910 2908 CONECT 2911 2907 2912 CONECT 2912 2911 CONECT 2913 2907 CONECT 2914 2906 2915 2925 CONECT 2915 2914 2916 2927 CONECT 2916 2915 2917 CONECT 2917 2916 2918 2925 CONECT 2918 2917 2919 2922 CONECT 2919 2918 2920 2921 CONECT 2920 2919 CONECT 2921 2919 CONECT 2922 2918 2923 CONECT 2923 2922 2924 2926 CONECT 2924 2923 2925 CONECT 2925 2914 2917 2924 CONECT 2926 2923 CONECT 2927 2915 CONECT 2928 2906 CONECT 2929 2904 CONECT 2930 2903 CONECT 2931 2903 MASTER 0 0 0 0 0 0 0 0 2925 6 63 27 END
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Structure:
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Protein Sequence Similarity
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120aa, >5O3R_1|Chains... at 100%
Complexes with the same small molecule ligand
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Entry Information
PDB ID
5o3q
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Membrane-associated protein slr1513
Ligand Name
CMP
EC.Number
E.C.-.-.-.-
Resolution
1.75(Å)
Affinity (Kd/Ki/IC50)
Kd=2.1uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Proc. Natl. Acad. Sci. U.S.A. Vol. 115: pp. E4861-E4869
Ligand Properties
Formula
C
1
0
H
1
3
N
5
O
6
P
Molecular Weight
330.214
Exact Mass
330.060
No. of atoms
35
No. of bonds
38
Polar Surface Area
171.59
LOGP Value
-2.64 (
Computed with XLOGP3
)
-0.67 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@@H]2OP(O)(O)OC[C@H]2O[C@H]1n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H14N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16-18,22H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P73954
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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